methyl (E)-12-[[(5S)-6-methoxy-5-[(2-methylpropan-2-yl)oxycarbonylamino]-6-oxidanylidene-hexyl]amino]-12-oxidanylidene-dodec-10-enoate

Systemtic Name: methyl (E)-12-[[(5S)-6-methoxy-5-[(2-methylpropan-2-yl)oxycarbonylamino]-6-oxidanylidene-hexyl]amino]-12-oxidanylidene-dodec-10-enoate Openeye Name: methyl (E)-12-[[(5S)-5-(tert-butoxycarbonylamino)-6-methoxy-6-oxo-hexyl]amino]-12-oxo-dodec-10-enoate CAS Name: (E)-12-[[(5S)-6-methoxy-5-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-6-oxohexyl]amino]-12-oxo-10-dodecenoic acid methyl ester IUPAC Name: methyl (E)-12-[[(5S)-6-methoxy-5-[(2-methylpropan-2-yl)oxycarbonylamino]-6-oxohexyl]amino]-12-oxododec-10-enoate Traditional Name: (E)-12-[[(5S)-5-(tert-butoxycarbonylamino)-6-keto-6-methoxy-hexyl]amino]-12-keto-dodec-10-enoic acid methyl ester Formula: C25H44N2O7 MolecularWeight: 484.62606

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CCCCNC(=O)C=CCCCCCCCCC(=O)OC)C(=O)OC

Isomeric SMILES

CC(C)(C)OC(=O)N[C@@H](CCCCNC(=O)/C=C/CCCCCCCCC(=O)OC)C(=O)OC

InChI

InChI=1S/C25H44N2O7/c1-25(2,3)34-24(31)27-20(23(30)33-5)16-14-15-19-26-21(28)17-12-10-8-6-7-9-11-13-18-22(29)32-4/h12,17,20H,6-11,13-16,18-19H2,1-5H3,(H,26,28)(H,27,31)/b17-12+/t20-/m0/s1