cyclohexylmethyl 4-(N'-octylcarbamimidoyl)benzoate hydrochloride

Systemtic Name: cyclohexylmethyl 4-(N'-octylcarbamimidoyl)benzoate hydrochloride Openeye Name: cyclohexylmethyl 4-(N'-octylcarbamimidoyl)benzoate hydrochloride CAS Name: 4-[amino(octylimino)methyl]benzoic acid cyclohexylmethyl ester hydrochloride IUPAC Name: cyclohexylmethyl 4-(N'-octylcarbamimidoyl)benzoate hydrochloride Traditional Name: 4-(N'-octylamidino)benzoic acid cyclohexylmethyl ester hydrochloride Formula: C23H37ClN2O2 MolecularWeight: 409.00508

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCN=C(C1=CC=C(C=C1)C(=O)OCC2CCCCC2)N.Cl

Isomeric SMILES

CCCCCCCCN=C(C1=CC=C(C=C1)C(=O)OCC2CCCCC2)N.Cl

InChI

InChI=1S/C23H36N2O2.ClH/c1-2-3-4-5-6-10-17-25-22(24)20-13-15-21(16-14-20)23(26)27-18-19-11-8-7-9-12-19;/h13-16,19H,2-12,17-18H2,1H3,(H2,24,25);1H