(phenylmethyl) N-[1-[(2-azanylcyclohexyl)amino]-4-methyl-pentan-2-yl]carbamate dihydrochloride

Systemtic Name: (phenylmethyl) N-[1-[(2-azanylcyclohexyl)amino]-4-methyl-pentan-2-yl]carbamate dihydrochloride Openeye Name: benzyl N-[1-[[(2-aminocyclohexyl)amino]methyl]-3-methyl-butyl]carbamate dihydrochloride CAS Name: N-[1-[(2-aminocyclohexyl)amino]-4-methylpentan-2-yl]carbamic acid (phenylmethyl) ester dihydrochloride IUPAC Name: benzyl N-[1-[(2-aminocyclohexyl)amino]-4-methylpentan-2-yl]carbamate dihydrochloride Traditional Name: N-[1-[[(2-aminocyclohexyl)amino]methyl]-3-methyl-butyl]carbamic acid benzyl ester dihydrochloride Formula: C20H35Cl2N3O2 MolecularWeight: 420.4168

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(CNC1CCCCC1N)NC(=O)OCC2=CC=CC=C2.Cl.Cl

Isomeric SMILES

CC(C)CC(CNC1CCCCC1N)NC(=O)OCC2=CC=CC=C2.Cl.Cl

InChI

InChI=1S/C20H33N3O2.2ClH/c1-15(2)12-17(13-22-19-11-7-6-10-18(19)21)23-20(24)25-14-16-8-4-3-5-9-16;;/h3-5,8-9,15,17-19,22H,6-7,10-14,21H2,1-2H3,(H,23,24);2*1H