2-[2-[(1-ethoxy-1-oxidanylidene-4-phenyl-butan-2-yl)amino]propanoyl-[(2-ethylphenyl)methylamino]amino]ethanoic acid

Systemtic Name: 2-[2-[(1-ethoxy-1-oxidanylidene-4-phenyl-butan-2-yl)amino]propanoyl-[(2-ethylphenyl)methylamino]amino]ethanoic acid Openeye Name: 2-[2-[(1-ethoxycarbonyl-3-phenyl-propyl)amino]propanoyl-[(2-ethylphenyl)methylamino]amino]acetic acid CAS Name: 2-[[2-[(1-ethoxy-1-oxo-4-phenylbutan-2-yl)amino]-1-oxopropyl]-[(2-ethylphenyl)methylamino]amino]acetic acid IUPAC Name: 2-[2-[(1-ethoxy-1-oxo-4-phenylbutan-2-yl)amino]propanoyl-[(2-ethylphenyl)methylamino]amino]acetic acid Traditional Name: 2-[2-[(1-carbethoxy-3-phenyl-propyl)amino]propanoyl-[(2-ethylbenzyl)amino]amino]acetic acid Formula: C26H35N3O5 MolecularWeight: 469.5732

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1CNN(CC(=O)O)C(=O)C(C)NC(CCC2=CC=CC=C2)C(=O)OCC

Isomeric SMILES

CCC1=CC=CC=C1CNN(CC(=O)O)C(=O)C(C)NC(CCC2=CC=CC=C2)C(=O)OCC

InChI

InChI=1S/C26H35N3O5/c1-4-21-13-9-10-14-22(21)17-27-29(18-24(30)31)25(32)19(3)28-23(26(33)34-5-2)16-15-20-11-7-6-8-12-20/h6-14,19,23,27-28H,4-5,15-18H2,1-3H3,(H,30,31)