[(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] pent-4-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] pent-4-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] pent-4-enoate CAS Name: 4-pentenoic 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] pent-4-enoate Traditional Name: pent-4-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: C27H40N2O5 MolecularWeight: 472.6169

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H40N2O5/c1-6-8-15-25(32)34-19-23(27(3,4)5)29-26(33)21(12-7-2)17-24(31)28-22(18-30)16-20-13-10-9-11-14-20/h6-7,9-11,13-14,21-23,30H,1-2,8,12,15-19H2,3-5H3,(H,28,31)(H,29,33)/t21-,22+,23-/m1/s1