methyl 3-azanyl-4-(butanoylamino)-5-methyl-cyclohexane-1-carboxylate

Systemtic Name: methyl 3-azanyl-4-(butanoylamino)-5-methyl-cyclohexane-1-carboxylate Openeye Name: methyl 3-amino-4-(butanoylamino)-5-methyl-cyclohexanecarboxylate CAS Name: 3-amino-5-methyl-4-(1-oxobutylamino)-1-cyclohexanecarboxylic acid methyl ester IUPAC Name: methyl 3-amino-4-(butanoylamino)-5-methylcyclohexane-1-carboxylate Traditional Name: 3-amino-4-butyramido-5-methyl-cyclohexanecarboxylic acid methyl ester Formula: C13H24N2O3 MolecularWeight: 256.34126

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)NC1C(CC(CC1N)C(=O)OC)C

Isomeric SMILES

CCCC(=O)NC1C(CC(CC1N)C(=O)OC)C

InChI

InChI=1S/C13H24N2O3/c1-4-5-11(16)15-12-8(2)6-9(7-10(12)14)13(17)18-3/h8-10,12H,4-7,14H2,1-3H3,(H,15,16)