2-[(1-ethoxy-1-oxidanylidene-4-phenyl-butan-2-yl)amino]-3-(1H-indol-3-yl)propanoic acid

Systemtic Name: 2-[(1-ethoxy-1-oxidanylidene-4-phenyl-butan-2-yl)amino]-3-(1H-indol-3-yl)propanoic acid Openeye Name: 2-[(1-ethoxycarbonyl-3-phenyl-propyl)amino]-3-(1H-indol-3-yl)propanoic acid CAS Name: 2-[(1-ethoxy-1-oxo-4-phenylbutan-2-yl)amino]-3-(1H-indol-3-yl)propanoic acid IUPAC Name: 2-[(1-ethoxy-1-oxo-4-phenylbutan-2-yl)amino]-3-(1H-indol-3-yl)propanoic acid Traditional Name: 2-[(1-carbethoxy-3-phenyl-propyl)amino]-3-(1H-indol-3-yl)propionic acid Formula: C23H26N2O4 MolecularWeight: 394.46354

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CCC1=CC=CC=C1)NC(CC2=CNC3=CC=CC=C32)C(=O)O

Isomeric SMILES

CCOC(=O)C(CCC1=CC=CC=C1)NC(CC2=CNC3=CC=CC=C32)C(=O)O

InChI

InChI=1S/C23H26N2O4/c1-2-29-23(28)20(13-12-16-8-4-3-5-9-16)25-21(22(26)27)14-17-15-24-19-11-7-6-10-18(17)19/h3-11,15,20-21,24-25H,2,12-14H2,1H3,(H,26,27)