이름: 1-(tert-butoxycarbonylamino-methyl)-6,7-dimethoxy-isoquinoline-4-carboxylic acid

IUPAC: 6,7-dimethoxy-1-[[(2-methylpropan-2-yl)oxycarbonylamino]methyl]isoquinoline-4-carboxylic acid

SMILES: COc1cc2c(C(=O)O)cnc(CNC(=O)OC(C)(C)C)c2cc1OC

Canonical SMILES: CC(C)(C)OC(=O)NCC1=NC=C(C2=CC(=C(C=C21)OC)OC)C(=O)O

분자식: C18H22N2O6

분자량: 362.40

InChIKey: LXTRLKRRDMLCDZ-UHFFFAOYSA-N

InChI:

InChI=1S/C18H22N2O6/c1-18(2,3)26-17(23)20-9-13-11-7-15(25-5)14(24-4)6-10(11)12(8-19-13)16(21)22/h6-8H,9H2,1-5H3,(H,20,23)(H,21,22)

동의어

SCHEMBL3365213LXTRLKRRDMLCDZ-UHFFFAOYSA-N1-(tert-Butoxycarbonylamino-methyl)-6,7-dimethoxy-isoquinoline-4-carboxylic acid

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