2-[[5-methoxy-2-methyl-1-(phenylmethyl)indol-3-yl]carbonylamino]propanoic acid

Systemtic Name: 2-[[5-methoxy-2-methyl-1-(phenylmethyl)indol-3-yl]carbonylamino]propanoic acid Openeye Name: 2-[(1-benzyl-5-methoxy-2-methyl-indole-3-carbonyl)amino]propanoic acid CAS Name: 2-[[[5-methoxy-2-methyl-1-(phenylmethyl)-3-indolyl]-oxomethyl]amino]propanoic acid IUPAC Name: 2-[(1-benzyl-5-methoxy-2-methylindole-3-carbonyl)amino]propanoic acid Traditional Name: 2-[(1-benzyl-5-methoxy-2-methyl-indole-3-carbonyl)amino]propionic acid Formula: C21H22N2O4 MolecularWeight: 366.41038

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(N1CC3=CC=CC=C3)C=CC(=C2)OC)C(=O)NC(C)C(=O)O

Isomeric SMILES

CC1=C(C2=C(N1CC3=CC=CC=C3)C=CC(=C2)OC)C(=O)NC(C)C(=O)O

InChI

InChI=1S/C21H22N2O4/c1-13(21(25)26)22-20(24)19-14(2)23(12-15-7-5-4-6-8-15)18-10-9-16(27-3)11-17(18)19/h4-11,13H,12H2,1-3H3,(H,22,24)(H,25,26)