2-[[4-[4-[(2-acetamido-5-azanyl-5-oxidanylidene-pentanoyl)amino]phenyl]phenyl]carbonylamino]-3-phenyl-propanoic acid

Systemtic Name: 2-[[4-[4-[(2-acetamido-5-azanyl-5-oxidanylidene-pentanoyl)amino]phenyl]phenyl]carbonylamino]-3-phenyl-propanoic acid Openeye Name: 2-[[4-[4-[(2-acetamido-5-amino-5-oxo-pentanoyl)amino]phenyl]benzoyl]amino]-3-phenyl-propanoic acid CAS Name: 2-[[[4-[4-[(2-acetamido-5-amino-1,5-dioxopentyl)amino]phenyl]phenyl]-oxomethyl]amino]-3-phenylpropanoic acid IUPAC Name: 2-[[4-[4-[(2-acetamido-5-amino-5-oxopentanoyl)amino]phenyl]benzoyl]amino]-3-phenylpropanoic acid Traditional Name: 2-[[4-[4-[(2-acetamido-5-amino-5-keto-pentanoyl)amino]phenyl]benzoyl]amino]-3-phenyl-propionic acid Formula: C29H30N4O6 MolecularWeight: 530.5717

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(CCC(=O)N)C(=O)NC1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)NC(CC3=CC=CC=C3)C(=O)O

Isomeric SMILES

CC(=O)NC(CCC(=O)N)C(=O)NC1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)NC(CC3=CC=CC=C3)C(=O)O

InChI

InChI=1S/C29H30N4O6/c1-18(34)31-24(15-16-26(30)35)28(37)32-23-13-11-21(12-14-23)20-7-9-22(10-8-20)27(36)33-25(29(38)39)17-19-5-3-2-4-6-19/h2-14,24-25H,15-17H2,1H3,(H2,30,35)(H,31,34)(H,32,37)(H,33,36)(H,38,39)