3-cyclohexyl-3-[[5-oxidanylidene-1-[3-[(phenylmethyl)carbamoylamino]phenyl]pyrrolidin-3-yl]carbonylamino]propanoic acid

Systemtic Name: 3-cyclohexyl-3-[[5-oxidanylidene-1-[3-[(phenylmethyl)carbamoylamino]phenyl]pyrrolidin-3-yl]carbonylamino]propanoic acid Openeye Name: 3-[[1-[3-(benzylcarbamoylamino)phenyl]-5-oxo-pyrrolidine-3-carbonyl]amino]-3-cyclohexyl-propanoic acid CAS Name: 3-cyclohexyl-3-[[oxo-[5-oxo-1-[3-[[oxo-[(phenylmethyl)amino]methyl]amino]phenyl]-3-pyrrolidinyl]methyl]amino]propanoic acid IUPAC Name: 3-[[1-[3-(benzylcarbamoylamino)phenyl]-5-oxopyrrolidine-3-carbonyl]amino]-3-cyclohexylpropanoic acid Traditional Name: 3-[[1-[3-(benzylcarbamoylamino)phenyl]-5-keto-pyrrolidine-3-carbonyl]amino]-3-cyclohexyl-propionic acid Formula: C28H34N4O5 MolecularWeight: 506.59336

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C(CC(=O)O)NC(=O)C2CC(=O)N(C2)C3=CC(=CC=C3)NC(=O)NCC4=CC=CC=C4

Isomeric SMILES

C1CCC(CC1)C(CC(=O)O)NC(=O)C2CC(=O)N(C2)C3=CC(=CC=C3)NC(=O)NCC4=CC=CC=C4

InChI

InChI=1S/C28H34N4O5/c33-25-14-21(27(36)31-24(16-26(34)35)20-10-5-2-6-11-20)18-32(25)23-13-7-12-22(15-23)30-28(37)29-17-19-8-3-1-4-9-19/h1,3-4,7-9,12-13,15,20-21,24H,2,5-6,10-11,14,16-18H2,(H,31,36)(H,34,35)(H2,29,30,37)