[(2S)-3-cyclohexyl-2-[[(2R)-2-[2-[[1-(hydroxymethyl)cyclopentyl]amino]-2-oxidanylidene-ethyl]pent-4-enoyl]amino]propyl] (2R)-2-(phenylmethyl)hept-6-enoate

Systemtic Name: [(2S)-3-cyclohexyl-2-[[(2R)-2-[2-[[1-(hydroxymethyl)cyclopentyl]amino]-2-oxidanylidene-ethyl]pent-4-enoyl]amino]propyl] (2R)-2-(phenylmethyl)hept-6-enoate Openeye Name: [(2S)-3-cyclohexyl-2-[[(2R)-2-[2-[[1-(hydroxymethyl)cyclopentyl]amino]-2-oxo-ethyl]pent-4-enoyl]amino]propyl] (2R)-2-benzylhept-6-enoate CAS Name: (2R)-2-(phenylmethyl)-6-heptenoic acid [(2S)-3-cyclohexyl-2-[[(2R)-2-[2-[[1-(hydroxymethyl)cyclopentyl]amino]-2-oxoethyl]-1-oxopent-4-enyl]amino]propyl] ester IUPAC Name: [(2S)-3-cyclohexyl-2-[[(2R)-2-[2-[[1-(hydroxymethyl)cyclopentyl]amino]-2-oxoethyl]pent-4-enoyl]amino]propyl] (2R)-2-benzylhept-6-enoate Traditional Name: (2R)-2-benzylhept-6-enoic acid [(2S)-3-cyclohexyl-2-[[(2R)-2-[2-keto-2-[(1-methylolcyclopentyl)amino]ethyl]pent-4-enoyl]amino]propyl] ester Formula: C36H54N2O5 MolecularWeight: 594.82436

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Descriptors Computed from Structure

Canonical SMILES:

C=CCCCC(CC1=CC=CC=C1)C(=O)OCC(CC2CCCCC2)NC(=O)C(CC=C)CC(=O)NC3(CCCC3)CO

Isomeric SMILES

C=CCCC[C@H](CC1=CC=CC=C1)C(=O)OC[C@H](CC2CCCCC2)NC(=O)[C@H](CC=C)CC(=O)NC3(CCCC3)CO

InChI

InChI=1S/C36H54N2O5/c1-3-5-8-20-31(23-28-16-9-6-10-17-28)35(42)43-26-32(24-29-18-11-7-12-19-29)37-34(41)30(15-4-2)25-33(40)38-36(27-39)21-13-14-22-36/h3-4,6,9-10,16-17,29-32,39H,1-2,5,7-8,11-15,18-27H2,(H,37,41)(H,38,40)/t30-,31-,32+/m1/s1