2-[[1-ethoxy-1,4-bis(oxidanylidene)-4-phenyl-butan-2-yl]amino]-3-(4-ethoxyphenyl)propanoic acid

Systemtic Name: 2-[[1-ethoxy-1,4-bis(oxidanylidene)-4-phenyl-butan-2-yl]amino]-3-(4-ethoxyphenyl)propanoic acid Openeye Name: 2-[(1-ethoxycarbonyl-3-oxo-3-phenyl-propyl)amino]-3-(4-ethoxyphenyl)propanoic acid CAS Name: 2-[(1-ethoxy-1,4-dioxo-4-phenylbutan-2-yl)amino]-3-(4-ethoxyphenyl)propanoic acid IUPAC Name: 2-[(1-ethoxy-1,4-dioxo-4-phenylbutan-2-yl)amino]-3-(4-ethoxyphenyl)propanoic acid Traditional Name: 2-[(1-carbethoxy-3-keto-3-phenyl-propyl)amino]-3-p-phenetyl-propionic acid Formula: C23H27NO6 MolecularWeight: 413.46358

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)CC(C(=O)O)NC(CC(=O)C2=CC=CC=C2)C(=O)OCC

Isomeric SMILES

CCOC1=CC=C(C=C1)CC(C(=O)O)NC(CC(=O)C2=CC=CC=C2)C(=O)OCC

InChI

InChI=1S/C23H27NO6/c1-3-29-18-12-10-16(11-13-18)14-19(22(26)27)24-20(23(28)30-4-2)15-21(25)17-8-6-5-7-9-17/h5-13,19-20,24H,3-4,14-15H2,1-2H3,(H,26,27)