1-[2-[(1,5-dimethylindol-2-yl)carbonylamino]-3-phenyl-propanoyl]pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[2-[(1,5-dimethylindol-2-yl)carbonylamino]-3-phenyl-propanoyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-[2-[(1,5-dimethylindole-2-carbonyl)amino]-3-phenyl-propanoyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[2-[[(1,5-dimethyl-2-indolyl)-oxomethyl]amino]-1-oxo-3-phenylpropyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[2-[(1,5-dimethylindole-2-carbonyl)amino]-3-phenylpropanoyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-[2-[(1,5-dimethylindole-2-carbonyl)amino]-3-phenyl-propanoyl]proline Formula: C25H27N3O4 MolecularWeight: 433.49958

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N(C(=C2)C(=O)NC(CC3=CC=CC=C3)C(=O)N4CCCC4C(=O)O)C

Isomeric SMILES

CC1=CC2=C(C=C1)N(C(=C2)C(=O)NC(CC3=CC=CC=C3)C(=O)N4CCCC4C(=O)O)C

InChI

InChI=1S/C25H27N3O4/c1-16-10-11-20-18(13-16)15-22(27(20)2)23(29)26-19(14-17-7-4-3-5-8-17)24(30)28-12-6-9-21(28)25(31)32/h3-5,7-8,10-11,13,15,19,21H,6,9,12,14H2,1-2H3,(H,26,29)(H,31,32)