[2-(1-methyl-2-phenyl-indol-3-yl)-2-oxidanylidene-ethyl] 3-acetamidopropanoate

Systemtic Name: [2-(1-methyl-2-phenyl-indol-3-yl)-2-oxidanylidene-ethyl] 3-acetamidopropanoate Openeye Name: [2-(1-methyl-2-phenyl-indol-3-yl)-2-oxo-ethyl] 3-acetamidopropanoate CAS Name: 3-acetamidopropanoic acid [2-(1-methyl-2-phenyl-3-indolyl)-2-oxoethyl] ester IUPAC Name: [2-(1-methyl-2-phenylindol-3-yl)-2-oxoethyl] 3-acetamidopropanoate Traditional Name: 3-acetamidopropionic acid [2-keto-2-(1-methyl-2-phenyl-indol-3-yl)ethyl] ester Formula: C22H22N2O4 MolecularWeight: 378.42108

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NCCC(=O)OCC(=O)C1=C(N(C2=CC=CC=C21)C)C3=CC=CC=C3

Isomeric SMILES

CC(=O)NCCC(=O)OCC(=O)C1=C(N(C2=CC=CC=C21)C)C3=CC=CC=C3

InChI

InChI=1S/C22H22N2O4/c1-15(25)23-13-12-20(27)28-14-19(26)21-17-10-6-7-11-18(17)24(2)22(21)16-8-4-3-5-9-16/h3-11H,12-14H2,1-2H3,(H,23,25)