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

Systemtic Name: 2-[2-[[5-methoxy-2-methyl-1-(phenylmethyl)indol-3-yl]carbonylamino]propanoylamino]propanoic acid Openeye Name: 2-[2-[(1-benzyl-5-methoxy-2-methyl-indole-3-carbonyl)amino]propanoylamino]propanoic acid CAS Name: 2-[[2-[[[5-methoxy-2-methyl-1-(phenylmethyl)-3-indolyl]-oxomethyl]amino]-1-oxopropyl]amino]propanoic acid IUPAC Name: 2-[2-[(1-benzyl-5-methoxy-2-methylindole-3-carbonyl)amino]propanoylamino]propanoic acid Traditional Name: 2-[2-[(1-benzyl-5-methoxy-2-methyl-indole-3-carbonyl)amino]propanoylamino]propionic acid Formula: C24H27N3O5 MolecularWeight: 437.48828

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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)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)NC(C)C(=O)O

InChI

InChI=1S/C24H27N3O5/c1-14(22(28)26-15(2)24(30)31)25-23(29)21-16(3)27(13-17-8-6-5-7-9-17)20-11-10-18(32-4)12-19(20)21/h5-12,14-15H,13H2,1-4H3,(H,25,29)(H,26,28)(H,30,31)