[1-[[4-[(1-cyclohexyl-4-methyl-2-oxidanylidene-pentan-3-yl)-methoxycarbonyl-amino]-1-phenyl-butyl]amino]-2-(methoxycarbonylamino)-3-methyl-1-oxidanylidene-butan-2-yl] pentanoate

Systemtic Name: [1-[[4-[(1-cyclohexyl-4-methyl-2-oxidanylidene-pentan-3-yl)-methoxycarbonyl-amino]-1-phenyl-butyl]amino]-2-(methoxycarbonylamino)-3-methyl-1-oxidanylidene-butan-2-yl] pentanoate Openeye Name: [1-[[4-[(3-cyclohexyl-1-isopropyl-2-oxo-propyl)-methoxycarbonyl-amino]-1-phenyl-butyl]carbamoyl]-1-(methoxycarbonylamino)-2-methyl-propyl] pentanoate CAS Name: pentanoic acid [1-[[4-[(1-cyclohexyl-4-methyl-2-oxopentan-3-yl)-methoxycarbonylamino]-1-phenylbutyl]amino]-2-(methoxycarbonylamino)-3-methyl-1-oxobutan-2-yl] ester IUPAC Name: [1-[[4-[(1-cyclohexyl-4-methyl-2-oxopentan-3-yl)-methoxycarbonylamino]-1-phenylbutyl]amino]-2-(methoxycarbonylamino)-3-methyl-1-oxobutan-2-yl] pentanoate Traditional Name: valeric acid [1-(carbomethoxyamino)-1-[[4-[carbomethoxy-(3-cyclohexyl-1-isopropyl-2-keto-propyl)amino]-1-phenyl-butyl]carbamoyl]-2-methyl-propyl] ester Formula: C36H57N3O8 MolecularWeight: 659.85308

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)OC(C(C)C)(C(=O)NC(CCCN(C(C(C)C)C(=O)CC1CCCCC1)C(=O)OC)C2=CC=CC=C2)NC(=O)OC

Isomeric SMILES

CCCCC(=O)OC(C(C)C)(C(=O)NC(CCCN(C(C(C)C)C(=O)CC1CCCCC1)C(=O)OC)C2=CC=CC=C2)NC(=O)OC

InChI

InChI=1S/C36H57N3O8/c1-8-9-22-31(41)47-36(26(4)5,38-34(43)45-6)33(42)37-29(28-19-14-11-15-20-28)21-16-23-39(35(44)46-7)32(25(2)3)30(40)24-27-17-12-10-13-18-27/h11,14-15,19-20,25-27,29,32H,8-10,12-13,16-18,21-24H2,1-7H3,(H,37,42)(H,38,43)