5-acetamido-3-(aminocarbonylamino)-2-(phenylmethoxycarbonylamino)-2-(4-phenylphenyl)pentanoic acid

Systemtic Name: 5-acetamido-3-(aminocarbonylamino)-2-(phenylmethoxycarbonylamino)-2-(4-phenylphenyl)pentanoic acid Openeye Name: 5-acetamido-2-(benzyloxycarbonylamino)-2-(4-phenylphenyl)-3-ureido-pentanoic acid CAS Name: 5-acetamido-3-(carbamoylamino)-2-(phenylmethoxycarbonylamino)-2-(4-phenylphenyl)pentanoic acid IUPAC Name: 5-acetamido-3-(carbamoylamino)-2-(phenylmethoxycarbonylamino)-2-(4-phenylphenyl)pentanoic acid Traditional Name: 5-acetamido-2-(benzyloxycarbonylamino)-2-(4-phenylphenyl)-3-ureido-valeric acid Formula: C28H30N4O6 MolecularWeight: 518.561

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NCCC(C(C1=CC=C(C=C1)C2=CC=CC=C2)(C(=O)O)NC(=O)OCC3=CC=CC=C3)NC(=O)N

Isomeric SMILES

CC(=O)NCCC(C(C1=CC=C(C=C1)C2=CC=CC=C2)(C(=O)O)NC(=O)OCC3=CC=CC=C3)NC(=O)N

InChI

InChI=1S/C28H30N4O6/c1-19(33)30-17-16-24(31-26(29)36)28(25(34)35,32-27(37)38-18-20-8-4-2-5-9-20)23-14-12-22(13-15-23)21-10-6-3-7-11-21/h2-15,24H,16-18H2,1H3,(H,30,33)(H,32,37)(H,34,35)(H3,29,31,36)