dipropan-2-yl 3-(3-nitrophenyl)carbonylpyrrolo[2,1-a]isoquinoline-1,2-dicarboxylate

Systemtic Name: dipropan-2-yl 3-(3-nitrophenyl)carbonylpyrrolo[2,1-a]isoquinoline-1,2-dicarboxylate Openeye Name: diisopropyl 3-(3-nitrobenzoyl)pyrrolo[2,1-a]isoquinoline-1,2-dicarboxylate CAS Name: 3-[(3-nitrophenyl)-oxomethyl]pyrrolo[2,1-a]isoquinoline-1,2-dicarboxylic acid dipropan-2-yl ester IUPAC Name: dipropan-2-yl 3-(3-nitrobenzoyl)pyrrolo[2,1-a]isoquinoline-1,2-dicarboxylate Traditional Name: 3-(3-nitrobenzoyl)pyrrol[2,1-a]isoquinoline-1,2-dicarboxylic acid diisopropyl ester Formula: C27H24N2O7 MolecularWeight: 488.48866

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)C1=C2C3=CC=CC=C3C=CN2C(=C1C(=O)OC(C)C)C(=O)C4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

CC(C)OC(=O)C1=C2C3=CC=CC=C3C=CN2C(=C1C(=O)OC(C)C)C(=O)C4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C27H24N2O7/c1-15(2)35-26(31)21-22(27(32)36-16(3)4)24(25(30)18-9-7-10-19(14-18)29(33)34)28-13-12-17-8-5-6-11-20(17)23(21)28/h5-16H,1-4H3