ethyl (E)-2-[aminocarbonyl-(3-methyl-3-oxidanyl-nonyl)amino]-10-oxidanylidene-undec-2-enoate

Systemtic Name: ethyl (E)-2-[aminocarbonyl-(3-methyl-3-oxidanyl-nonyl)amino]-10-oxidanylidene-undec-2-enoate Openeye Name: ethyl (E)-2-[carbamoyl-(3-hydroxy-3-methyl-nonyl)amino]-10-oxo-undec-2-enoate CAS Name: (E)-2-[carbamoyl-(3-hydroxy-3-methylnonyl)amino]-10-oxo-2-undecenoic acid ethyl ester IUPAC Name: ethyl (E)-2-[carbamoyl-(3-hydroxy-3-methylnonyl)amino]-10-oxoundec-2-enoate Traditional Name: (E)-2-[carbamoyl-(3-hydroxy-3-methyl-nonyl)amino]-10-keto-undec-2-enoic acid ethyl ester Formula: C24H44N2O5 MolecularWeight: 440.61656

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C)(CCN(C(=CCCCCCCC(=O)C)C(=O)OCC)C(=O)N)O

Isomeric SMILES

CCCCCCC(C)(CCN(/C(=C/CCCCCCC(=O)C)/C(=O)OCC)C(=O)N)O

InChI

InChI=1S/C24H44N2O5/c1-5-7-8-14-17-24(4,30)18-19-26(23(25)29)21(22(28)31-6-2)16-13-11-9-10-12-15-20(3)27/h16,30H,5-15,17-19H2,1-4H3,(H2,25,29)/b21-16+