methyl 4-(1-azanylbutylidene)-1-(3-chloranylpropyl)-3,5-bis(oxidanylidene)cyclohexane-1-carboxylate

Systemtic Name: methyl 4-(1-azanylbutylidene)-1-(3-chloranylpropyl)-3,5-bis(oxidanylidene)cyclohexane-1-carboxylate Openeye Name: methyl 4-(1-aminobutylidene)-1-(3-chloropropyl)-3,5-dioxo-cyclohexanecarboxylate CAS Name: 4-(1-aminobutylidene)-1-(3-chloropropyl)-3,5-dioxo-1-cyclohexanecarboxylic acid methyl ester IUPAC Name: methyl 4-(1-aminobutylidene)-1-(3-chloropropyl)-3,5-dioxocyclohexane-1-carboxylate Traditional Name: 4-(1-aminobutylidene)-1-(3-chloropropyl)-3,5-diketo-cyclohexanecarboxylic acid methyl ester Formula: C15H22ClNO4 MolecularWeight: 315.79248

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=C1C(=O)CC(CC1=O)(CCCCl)C(=O)OC)N

Isomeric SMILES

CCCC(=C1C(=O)CC(CC1=O)(CCCCl)C(=O)OC)N

InChI

InChI=1S/C15H22ClNO4/c1-3-5-10(17)13-11(18)8-15(6-4-7-16,9-12(13)19)14(20)21-2/h3-9,17H2,1-2H3