[(2S)-3,3-dimethyl-2-[[(2R)-2-[2-oxidanylidene-2-[[(2S)-1-oxidanyl-3-phenyl-propan-2-yl]amino]ethyl]pent-4-enoyl]amino]butyl] (2R)-2-(phenylmethyl)hex-5-enoate

Systemtic Name: [(2S)-3,3-dimethyl-2-[[(2R)-2-[2-oxidanylidene-2-[[(2S)-1-oxidanyl-3-phenyl-propan-2-yl]amino]ethyl]pent-4-enoyl]amino]butyl] (2R)-2-(phenylmethyl)hex-5-enoate Openeye Name: [(2S)-2-[[(2R)-2-[2-[[(1S)-1-benzyl-2-hydroxy-ethyl]amino]-2-oxo-ethyl]pent-4-enoyl]amino]-3,3-dimethyl-butyl] (2R)-2-benzylhex-5-enoate CAS Name: (2R)-2-(phenylmethyl)-5-hexenoic acid [(2S)-2-[[(2R)-2-[2-[[(2S)-1-hydroxy-3-phenylpropan-2-yl]amino]-2-oxoethyl]-1-oxopent-4-enyl]amino]-3,3-dimethylbutyl] ester IUPAC Name: [(2S)-2-[[(2R)-2-[2-[[(2S)-1-hydroxy-3-phenylpropan-2-yl]amino]-2-oxoethyl]pent-4-enoyl]amino]-3,3-dimethylbutyl] (2R)-2-benzylhex-5-enoate Traditional Name: (2R)-2-benzylhex-5-enoic acid [(2S)-2-[[(2R)-2-[2-[[(1S)-1-benzyl-2-hydroxy-ethyl]amino]-2-keto-ethyl]pent-4-enoyl]amino]-3,3-dimethyl-butyl] ester Formula: C35H48N2O5 MolecularWeight: 576.76602

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(COC(=O)C(CCC=C)CC1=CC=CC=C1)NC(=O)C(CC=C)CC(=O)NC(CC2=CC=CC=C2)CO

Isomeric SMILES

CC(C)(C)[C@@H](COC(=O)[C@H](CCC=C)CC1=CC=CC=C1)NC(=O)[C@H](CC=C)CC(=O)N[C@@H](CC2=CC=CC=C2)CO

InChI

InChI=1S/C35H48N2O5/c1-6-8-20-29(21-26-16-11-9-12-17-26)34(41)42-25-31(35(3,4)5)37-33(40)28(15-7-2)23-32(39)36-30(24-38)22-27-18-13-10-14-19-27/h6-7,9-14,16-19,28-31,38H,1-2,8,15,20-25H2,3-5H3,(H,36,39)(H,37,40)/t28-,29-,30+,31-/m1/s1