2-[2-[(1,5-dimethylindol-2-yl)carbonylamino]propanoylamino]-2-phenyl-ethanoic acid

Systemtic Name: 2-[2-[(1,5-dimethylindol-2-yl)carbonylamino]propanoylamino]-2-phenyl-ethanoic acid Openeye Name: 2-[2-[(1,5-dimethylindole-2-carbonyl)amino]propanoylamino]-2-phenyl-acetic acid CAS Name: 2-[[2-[[(1,5-dimethyl-2-indolyl)-oxomethyl]amino]-1-oxopropyl]amino]-2-phenylacetic acid IUPAC Name: 2-[2-[(1,5-dimethylindole-2-carbonyl)amino]propanoylamino]-2-phenylacetic acid Traditional Name: 2-[2-[(1,5-dimethylindole-2-carbonyl)amino]propanoylamino]-2-phenyl-acetic acid Formula: C22H23N3O4 MolecularWeight: 393.43572

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H23N3O4/c1-13-9-10-17-16(11-13)12-18(25(17)3)21(27)23-14(2)20(26)24-19(22(28)29)15-7-5-4-6-8-15/h4-12,14,19H,1-3H3,(H,23,27)(H,24,26)(H,28,29)