dipropan-2-yl 3-(4-chlorophenyl)carbonylpyrrolo[2,1-a]isoquinoline-1,2-dicarboxylate

Systemtic Name: dipropan-2-yl 3-(4-chlorophenyl)carbonylpyrrolo[2,1-a]isoquinoline-1,2-dicarboxylate Openeye Name: diisopropyl 3-(4-chlorobenzoyl)pyrrolo[2,1-a]isoquinoline-1,2-dicarboxylate CAS Name: 3-[(4-chlorophenyl)-oxomethyl]pyrrolo[2,1-a]isoquinoline-1,2-dicarboxylic acid dipropan-2-yl ester IUPAC Name: dipropan-2-yl 3-(4-chlorobenzoyl)pyrrolo[2,1-a]isoquinoline-1,2-dicarboxylate Traditional Name: 3-(4-chlorobenzoyl)pyrrol[2,1-a]isoquinoline-1,2-dicarboxylic acid diisopropyl ester Formula: C27H24ClNO5 MolecularWeight: 477.93616

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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=C(C=C4)Cl

Isomeric SMILES

CC(C)OC(=O)C1=C2C3=CC=CC=C3C=CN2C(=C1C(=O)OC(C)C)C(=O)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C27H24ClNO5/c1-15(2)33-26(31)21-22(27(32)34-16(3)4)24(25(30)18-9-11-19(28)12-10-18)29-14-13-17-7-5-6-8-20(17)23(21)29/h5-16H,1-4H3