[(2S)-3,3-dimethyl-2-[[(2R)-2-[2-oxidanylidene-2-[[(2S)-1-oxidanylpropan-2-yl]amino]ethyl]pent-4-enoyl]amino]butyl] hept-6-enoate

Systemtic Name: [(2S)-3,3-dimethyl-2-[[(2R)-2-[2-oxidanylidene-2-[[(2S)-1-oxidanylpropan-2-yl]amino]ethyl]pent-4-enoyl]amino]butyl] hept-6-enoate Openeye Name: [(2S)-2-[[(2R)-2-[2-[[(1S)-2-hydroxy-1-methyl-ethyl]amino]-2-oxo-ethyl]pent-4-enoyl]amino]-3,3-dimethyl-butyl] hept-6-enoate CAS Name: 6-heptenoic acid [(2S)-2-[[(2R)-2-[2-[[(2S)-1-hydroxypropan-2-yl]amino]-2-oxoethyl]-1-oxopent-4-enyl]amino]-3,3-dimethylbutyl] ester IUPAC Name: [(2S)-2-[[(2R)-2-[2-[[(2S)-1-hydroxypropan-2-yl]amino]-2-oxoethyl]pent-4-enoyl]amino]-3,3-dimethylbutyl] hept-6-enoate Traditional Name: hept-6-enoic acid [(2S)-2-[[(2R)-2-[2-[[(1S)-2-hydroxy-1-methyl-ethyl]amino]-2-keto-ethyl]pent-4-enoyl]amino]-3,3-dimethyl-butyl] ester Formula: C23H40N2O5 MolecularWeight: 424.5741

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Descriptors Computed from Structure

Canonical SMILES:

CC(CO)NC(=O)CC(CC=C)C(=O)NC(COC(=O)CCCCC=C)C(C)(C)C

Isomeric SMILES

C[C@@H](CO)NC(=O)C[C@@H](CC=C)C(=O)N[C@H](COC(=O)CCCCC=C)C(C)(C)C

InChI

InChI=1S/C23H40N2O5/c1-7-9-10-11-13-21(28)30-16-19(23(4,5)6)25-22(29)18(12-8-2)14-20(27)24-17(3)15-26/h7-8,17-19,26H,1-2,9-16H2,3-6H3,(H,24,27)(H,25,29)/t17-,18+,19+/m0/s1