2-[[(3-azanyl-3-oxidanylidene-2-phenylmethoxy-propyl)-(2-methylpropyl)carbamoyl]amino]-3-(4-phenylphenyl)propanoic acid

Systemtic Name: 2-[[(3-azanyl-3-oxidanylidene-2-phenylmethoxy-propyl)-(2-methylpropyl)carbamoyl]amino]-3-(4-phenylphenyl)propanoic acid Openeye Name: 2-[[(3-amino-2-benzyloxy-3-oxo-propyl)-isobutyl-carbamoyl]amino]-3-(4-phenylphenyl)propanoic acid CAS Name: 2-[[[(3-amino-3-oxo-2-phenylmethoxypropyl)-(2-methylpropyl)amino]-oxomethyl]amino]-3-(4-phenylphenyl)propanoic acid IUPAC Name: 2-[[(3-amino-3-oxo-2-phenylmethoxypropyl)-(2-methylpropyl)carbamoyl]amino]-3-(4-phenylphenyl)propanoic acid Traditional Name: 2-[[(3-amino-2-benzoxy-3-keto-propyl)-isobutyl-carbamoyl]amino]-3-(4-phenylphenyl)propionic acid Formula: C30H35N3O5 MolecularWeight: 517.616

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN(CC(C(=O)N)OCC1=CC=CC=C1)C(=O)NC(CC2=CC=C(C=C2)C3=CC=CC=C3)C(=O)O

Isomeric SMILES

CC(C)CN(CC(C(=O)N)OCC1=CC=CC=C1)C(=O)NC(CC2=CC=C(C=C2)C3=CC=CC=C3)C(=O)O

InChI

InChI=1S/C30H35N3O5/c1-21(2)18-33(19-27(28(31)34)38-20-23-9-5-3-6-10-23)30(37)32-26(29(35)36)17-22-13-15-25(16-14-22)24-11-7-4-8-12-24/h3-16,21,26-27H,17-20H2,1-2H3,(H2,31,34)(H,32,37)(H,35,36)