名称: 4-isopropyl-7-nitro-2,3,4,5-tetrahydro-1,4-benzoxazepine

IUPAC: 7-nitro-4-propan-2-yl-3,5-dihydro-2H-1,4-benzoxazepine

SMILES: CC(C)N1CCOc2ccc([N+](=O)[O-])cc2C1

Canonical SMILES: CC(C)N1CCOC2=C(C1)C=C(C=C2)[N+](=O)[O-]

分子式: C12H16N2O3

分子量: 236.27

InChIKey: HOUVQAHUZOIJGO-UHFFFAOYSA-N

InChI: InChI=1S/C12H16N2O3/c1-9(2)13-5-6-17-12-4-3-11(14(15)16)7-10(12)8-13/h3-4,7,9H,5-6,8H2,1-2H3

同義語

SCHEMBL7479469HOUVQAHUZOIJGO-UHFFFAOYSA-N4-isopropyl-7-nitro-2,3,4,5-tetrahydro-1,4-benzoxazepine

拡張検索