3-azanyl-4-[[3-cyclohexyl-1-(diphenylmethyl)oxy-1-oxidanylidene-propan-2-yl]amino]-4-oxidanylidene-butanoic acid

Systemtic Name: 3-azanyl-4-[[3-cyclohexyl-1-(diphenylmethyl)oxy-1-oxidanylidene-propan-2-yl]amino]-4-oxidanylidene-butanoic acid Openeye Name: 3-amino-4-[[2-benzhydryloxy-1-(cyclohexylmethyl)-2-oxo-ethyl]amino]-4-oxo-butanoic acid CAS Name: 3-amino-4-[[3-cyclohexyl-1-(diphenylmethyl)oxy-1-oxopropan-2-yl]amino]-4-oxobutanoic acid IUPAC Name: 3-amino-4-[(1-benzhydryloxy-3-cyclohexyl-1-oxopropan-2-yl)amino]-4-oxobutanoic acid Traditional Name: 3-amino-4-[[2-benzhydryloxy-1-(cyclohexylmethyl)-2-keto-ethyl]amino]-4-keto-butyric acid Formula: C26H32N2O5 MolecularWeight: 452.54268

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CC(C(=O)OC(C2=CC=CC=C2)C3=CC=CC=C3)NC(=O)C(CC(=O)O)N

Isomeric SMILES

C1CCC(CC1)CC(C(=O)OC(C2=CC=CC=C2)C3=CC=CC=C3)NC(=O)C(CC(=O)O)N

InChI

InChI=1S/C26H32N2O5/c27-21(17-23(29)30)25(31)28-22(16-18-10-4-1-5-11-18)26(32)33-24(19-12-6-2-7-13-19)20-14-8-3-9-15-20/h2-3,6-9,12-15,18,21-22,24H,1,4-5,10-11,16-17,27H2,(H,28,31)(H,29,30)