2-[3-[(4-methylphenyl)carbamoyl]-4-piperidin-1-yl-phenyl]-1,3-bis(oxidanylidene)isoindole-5-carboxylic acid

Systemtic Name: 2-[3-[(4-methylphenyl)carbamoyl]-4-piperidin-1-yl-phenyl]-1,3-bis(oxidanylidene)isoindole-5-carboxylic acid Openeye Name: 1,3-dioxo-2-[4-(1-piperidyl)-3-(p-tolylcarbamoyl)phenyl]isoindoline-5-carboxylic acid CAS Name: 2-[3-[(4-methylanilino)-oxomethyl]-4-(1-piperidinyl)phenyl]-1,3-dioxo-5-isoindolecarboxylic acid IUPAC Name: 2-[3-[(4-methylphenyl)carbamoyl]-4-piperidin-1-ylphenyl]-1,3-dioxoisoindole-5-carboxylic acid Traditional Name: 1,3-diketo-2-[4-piperidino-3-(p-tolylcarbamoyl)phenyl]isoindoline-5-carboxylic acid Formula: C28H25N3O5 MolecularWeight: 483.5152

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)C2=C(C=CC(=C2)N3C(=O)C4=C(C3=O)C=C(C=C4)C(=O)O)N5CCCCC5

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)C2=C(C=CC(=C2)N3C(=O)C4=C(C3=O)C=C(C=C4)C(=O)O)N5CCCCC5

InChI

InChI=1S/C28H25N3O5/c1-17-5-8-19(9-6-17)29-25(32)23-16-20(10-12-24(23)30-13-3-2-4-14-30)31-26(33)21-11-7-18(28(35)36)15-22(21)27(31)34/h5-12,15-16H,2-4,13-14H2,1H3,(H,29,32)(H,35,36)