3-[2-(cyclohexen-1-yl)ethyl]-6-(2-methylpropyl)-5-oxidanylidene-2-prop-2-enylimino-1,3-diazinane-1-carboxylic acid

Systemtic Name: 3-[2-(cyclohexen-1-yl)ethyl]-6-(2-methylpropyl)-5-oxidanylidene-2-prop-2-enylimino-1,3-diazinane-1-carboxylic acid Openeye Name: 2-allylimino-3-[2-(cyclohexen-1-yl)ethyl]-6-isobutyl-5-oxo-hexahydropyrimidine-1-carboxylic acid CAS Name: 3-[2-(1-cyclohexenyl)ethyl]-6-(2-methylpropyl)-5-oxo-2-prop-2-enylimino-1,3-diazinane-1-carboxylic acid IUPAC Name: 3-[2-(cyclohexen-1-yl)ethyl]-6-(2-methylpropyl)-5-oxo-2-prop-2-enylimino-1,3-diazinane-1-carboxylic acid Traditional Name: 2-allylimino-3-[2-(cyclohexen-1-yl)ethyl]-6-isobutyl-5-keto-hexahydropyrimidine-1-carboxylic acid Formula: C20H31N3O3 MolecularWeight: 361.47844

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1C(=O)CN(C(=NCC=C)N1C(=O)O)CCC2=CCCCC2

Isomeric SMILES

CC(C)CC1C(=O)CN(C(=NCC=C)N1C(=O)O)CCC2=CCCCC2

InChI

InChI=1S/C20H31N3O3/c1-4-11-21-19-22(12-10-16-8-6-5-7-9-16)14-18(24)17(13-15(2)3)23(19)20(25)26/h4,8,15,17H,1,5-7,9-14H2,2-3H3,(H,25,26)