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

Systemtic Name: 3-[[2-[(1,5-dimethylindol-2-yl)carbonylamino]-3-phenyl-propanoyl]amino]propanoic acid Openeye Name: 3-[[2-[(1,5-dimethylindole-2-carbonyl)amino]-3-phenyl-propanoyl]amino]propanoic acid CAS Name: 3-[[2-[[(1,5-dimethyl-2-indolyl)-oxomethyl]amino]-1-oxo-3-phenylpropyl]amino]propanoic acid IUPAC Name: 3-[[2-[(1,5-dimethylindole-2-carbonyl)amino]-3-phenylpropanoyl]amino]propanoic acid Traditional Name: 3-[[2-[(1,5-dimethylindole-2-carbonyl)amino]-3-phenyl-propanoyl]amino]propionic acid Formula: C23H25N3O4 MolecularWeight: 407.4623

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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)NCCC(=O)O)C

Isomeric SMILES

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

InChI

InChI=1S/C23H25N3O4/c1-15-8-9-19-17(12-15)14-20(26(19)2)23(30)25-18(13-16-6-4-3-5-7-16)22(29)24-11-10-21(27)28/h3-9,12,14,18H,10-11,13H2,1-2H3,(H,24,29)(H,25,30)(H,27,28)