methyl 2-[1-(hexanoylamino)-4-(methylamino)cyclohexyl]ethanoate

Systemtic Name: methyl 2-[1-(hexanoylamino)-4-(methylamino)cyclohexyl]ethanoate Openeye Name: methyl 2-[1-(hexanoylamino)-4-(methylamino)cyclohexyl]acetate CAS Name: 2-[4-(methylamino)-1-(1-oxohexylamino)cyclohexyl]acetic acid methyl ester IUPAC Name: methyl 2-[1-(hexanoylamino)-4-(methylamino)cyclohexyl]acetate Traditional Name: 2-[1-(caproylamino)-4-(methylamino)cyclohexyl]acetic acid methyl ester Formula: C16H30N2O3 MolecularWeight: 298.421

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)NC1(CCC(CC1)NC)CC(=O)OC

Isomeric SMILES

CCCCCC(=O)NC1(CCC(CC1)NC)CC(=O)OC

InChI

InChI=1S/C16H30N2O3/c1-4-5-6-7-14(19)18-16(12-15(20)21-3)10-8-13(17-2)9-11-16/h13,17H,4-12H2,1-3H3,(H,18,19)