3-[(2-carboxy-4-phenyl-butyl)-methyl-carbamoyl]-2,3-dihydro-1H-indole-2-carboxylic acid

Systemtic Name: 3-[(2-carboxy-4-phenyl-butyl)-methyl-carbamoyl]-2,3-dihydro-1H-indole-2-carboxylic acid Openeye Name: 3-[(2-carboxy-4-phenyl-butyl)-methyl-carbamoyl]indoline-2-carboxylic acid CAS Name: 3-[[(2-carboxy-4-phenylbutyl)-methylamino]-oxomethyl]-2,3-dihydro-1H-indole-2-carboxylic acid IUPAC Name: 3-[(2-carboxy-4-phenylbutyl)-methylcarbamoyl]-2,3-dihydro-1H-indole-2-carboxylic acid Traditional Name: 3-[(2-carboxy-4-phenyl-butyl)-methyl-carbamoyl]indoline-2-carboxylic acid Formula: C22H24N2O5 MolecularWeight: 396.43636

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC(CCC1=CC=CC=C1)C(=O)O)C(=O)C2C(NC3=CC=CC=C23)C(=O)O

Isomeric SMILES

CN(CC(CCC1=CC=CC=C1)C(=O)O)C(=O)C2C(NC3=CC=CC=C23)C(=O)O

InChI

InChI=1S/C22H24N2O5/c1-24(13-15(21(26)27)12-11-14-7-3-2-4-8-14)20(25)18-16-9-5-6-10-17(16)23-19(18)22(28)29/h2-10,15,18-19,23H,11-13H2,1H3,(H,26,27)(H,28,29)