3-(butoxycarbonylamino)-4-[(2-ethoxy-2-oxidanylidene-ethyl)-(phenylmethyl)amino]-4-oxidanylidene-butanoic acid

Systemtic Name: 3-(butoxycarbonylamino)-4-[(2-ethoxy-2-oxidanylidene-ethyl)-(phenylmethyl)amino]-4-oxidanylidene-butanoic acid Openeye Name: 4-[benzyl-(2-ethoxy-2-oxo-ethyl)amino]-3-(butoxycarbonylamino)-4-oxo-butanoic acid CAS Name: 3-[[butoxy(oxo)methyl]amino]-4-[(2-ethoxy-2-oxoethyl)-(phenylmethyl)amino]-4-oxobutanoic acid IUPAC Name: 4-[benzyl-(2-ethoxy-2-oxoethyl)amino]-3-(butoxycarbonylamino)-4-oxobutanoic acid Traditional Name: 4-[benzyl-(2-ethoxy-2-keto-ethyl)amino]-3-(butoxycarbonylamino)-4-keto-butyric acid Formula: C20H28N2O7 MolecularWeight: 408.44552

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)NC(CC(=O)O)C(=O)N(CC1=CC=CC=C1)CC(=O)OCC

Isomeric SMILES

CCCCOC(=O)NC(CC(=O)O)C(=O)N(CC1=CC=CC=C1)CC(=O)OCC

InChI

InChI=1S/C20H28N2O7/c1-3-5-11-29-20(27)21-16(12-17(23)24)19(26)22(14-18(25)28-4-2)13-15-9-7-6-8-10-15/h6-10,16H,3-5,11-14H2,1-2H3,(H,21,27)(H,23,24)