2-methyl-3-[2-methyl-1-[2-[methyl(phenethyl)amino]-2-oxidanylidene-ethyl]-4-phenylmethoxy-indol-3-yl]propanoic acid

Systemtic Name: 2-methyl-3-[2-methyl-1-[2-[methyl(phenethyl)amino]-2-oxidanylidene-ethyl]-4-phenylmethoxy-indol-3-yl]propanoic acid Openeye Name: 3-[4-benzyloxy-2-methyl-1-[2-[methyl(phenethyl)amino]-2-oxo-ethyl]indol-3-yl]-2-methyl-propanoic acid CAS Name: 2-methyl-3-[2-methyl-1-[2-[methyl(phenethyl)amino]-2-oxoethyl]-4-phenylmethoxy-3-indolyl]propanoic acid IUPAC Name: 2-methyl-3-[2-methyl-1-[2-[methyl(phenethyl)amino]-2-oxoethyl]-4-phenylmethoxyindol-3-yl]propanoic acid Traditional Name: 3-[4-benzoxy-1-[2-keto-2-[methyl(phenethyl)amino]ethyl]-2-methyl-indol-3-yl]-2-methyl-propionic acid Formula: C31H34N2O4 MolecularWeight: 498.61266

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(N1CC(=O)N(C)CCC3=CC=CC=C3)C=CC=C2OCC4=CC=CC=C4)CC(C)C(=O)O

Isomeric SMILES

CC1=C(C2=C(N1CC(=O)N(C)CCC3=CC=CC=C3)C=CC=C2OCC4=CC=CC=C4)CC(C)C(=O)O

InChI

InChI=1S/C31H34N2O4/c1-22(31(35)36)19-26-23(2)33(20-29(34)32(3)18-17-24-11-6-4-7-12-24)27-15-10-16-28(30(26)27)37-21-25-13-8-5-9-14-25/h4-16,22H,17-21H2,1-3H3,(H,35,36)