dimethyl 3-(1,3-benzodioxol-5-ylcarbamoyl)pyrrolo[2,1-a]isoquinoline-1,2-dicarboxylate

Systemtic Name: dimethyl 3-(1,3-benzodioxol-5-ylcarbamoyl)pyrrolo[2,1-a]isoquinoline-1,2-dicarboxylate Openeye Name: dimethyl 3-(1,3-benzodioxol-5-ylcarbamoyl)pyrrolo[2,1-a]isoquinoline-1,2-dicarboxylate CAS Name: 3-[(1,3-benzodioxol-5-ylamino)-oxomethyl]pyrrolo[2,1-a]isoquinoline-1,2-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 3-(1,3-benzodioxol-5-ylcarbamoyl)pyrrolo[2,1-a]isoquinoline-1,2-dicarboxylate Traditional Name: 3-(1,3-benzodioxol-5-ylcarbamoyl)pyrrol[2,1-a]isoquinoline-1,2-dicarboxylic acid dimethyl ester Formula: C24H18N2O7 MolecularWeight: 446.40892

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C2C3=CC=CC=C3C=CN2C(=C1C(=O)OC)C(=O)NC4=CC5=C(C=C4)OCO5

Isomeric SMILES

COC(=O)C1=C2C3=CC=CC=C3C=CN2C(=C1C(=O)OC)C(=O)NC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C24H18N2O7/c1-30-23(28)18-19(24(29)31-2)21(26-10-9-13-5-3-4-6-15(13)20(18)26)22(27)25-14-7-8-16-17(11-14)33-12-32-16/h3-11H,12H2,1-2H3,(H,25,27)