1-(3-methoxypropylcarbamoyl)-3-phenyl-5H-pyrrolo[2,1-a]isoindole-2-carboxylic acid

Systemtic Name: 1-(3-methoxypropylcarbamoyl)-3-phenyl-5H-pyrrolo[2,1-a]isoindole-2-carboxylic acid Openeye Name: 1-(3-methoxypropylcarbamoyl)-3-phenyl-5H-pyrrolo[2,1-a]isoindole-2-carboxylic acid CAS Name: 1-[(3-methoxypropylamino)-oxomethyl]-3-phenyl-5H-pyrrolo[2,1-a]isoindole-2-carboxylic acid IUPAC Name: 1-(3-methoxypropylcarbamoyl)-3-phenyl-5H-pyrrolo[2,1-a]isoindole-2-carboxylic acid Traditional Name: 1-(3-methoxypropylcarbamoyl)-3-phenyl-5H-pyrrol[2,1-a]isoindole-2-carboxylic acid Formula: C23H22N2O4 MolecularWeight: 390.43178

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Descriptors Computed from Structure

Canonical SMILES:

COCCCNC(=O)C1=C2C3=CC=CC=C3CN2C(=C1C(=O)O)C4=CC=CC=C4

Isomeric SMILES

COCCCNC(=O)C1=C2C3=CC=CC=C3CN2C(=C1C(=O)O)C4=CC=CC=C4

InChI

InChI=1S/C23H22N2O4/c1-29-13-7-12-24-22(26)18-19(23(27)28)20(15-8-3-2-4-9-15)25-14-16-10-5-6-11-17(16)21(18)25/h2-6,8-11H,7,12-14H2,1H3,(H,24,26)(H,27,28)