O=C(O)C1CN(C(=O)OCc2ccccc2)CCN1c1c([N+](=O)[O-])ccc(Cl)c1Cl
Название: 4-carbobenzyloxy-1-(5,6-dichloro-2-nitrophenyl)piperazine-2-carboxylic acid
IUPAC: 1-(2,3-dichloro-6-nitrophenyl)-4-phenylmethoxycarbonylpiperazine-2-carboxylic acid
SMILES: O=C(O)C1CN(C(=O)OCc2ccccc2)CCN1c1c([N+](=O)[O-])ccc(Cl)c1Cl
Canonical SMILES: C1CN(C(CN1C(=O)OCC2=CC=CC=C2)C(=O)O)C3=C(C=CC(=C3Cl)Cl)[N+](=O)[O-]
Молекулярная формула: C19H17Cl2N3O6
Молекулярная масса: 454.30
InChIKey: ZAYBSDCYYIJAJC-UHFFFAOYSA-N
InChI: InChI=1S/C19H17Cl2N3O6/c20-13-6-7-14(24(28)29)17(16(13)21)23-9-8-22(10-15(23)18(25)26)19(27)30-11-12-4-2-1-3-5-12/h1-7,15H,8-11H2,(H,25,26)
PubChem CID: 21976687

Синонимы

SCHEMBL5872553ZAYBSDCYYIJAJC-UHFFFAOYSA-N4-carbobenzyloxy-1-(5,6-dichloro-2-nitrophenyl)piperazine-2-carboxylic acid4-carbobenzyloxy-1-(5,6-dichloro-2-nitrophenyl) piperazine-2-carboxylic acid