methyl N-[3-[[(4-azanylcyclohexyl)-ethanoyl-amino]methyl]-4-chloranyl-phenyl]carbamate

Systemtic Name: methyl N-[3-[[(4-azanylcyclohexyl)-ethanoyl-amino]methyl]-4-chloranyl-phenyl]carbamate Openeye Name: methyl N-[3-[[acetyl-(4-aminocyclohexyl)amino]methyl]-4-chloro-phenyl]carbamate CAS Name: N-[3-[[acetyl-(4-aminocyclohexyl)amino]methyl]-4-chlorophenyl]carbamic acid methyl ester IUPAC Name: methyl N-[3-[[acetyl-(4-aminocyclohexyl)amino]methyl]-4-chlorophenyl]carbamate Traditional Name: N-[3-[[acetyl-(4-aminocyclohexyl)amino]methyl]-4-chloro-phenyl]carbamic acid methyl ester Formula: C17H24ClN3O3 MolecularWeight: 353.84376

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N(CC1=C(C=CC(=C1)NC(=O)OC)Cl)C2CCC(CC2)N

Isomeric SMILES

CC(=O)N(CC1=C(C=CC(=C1)NC(=O)OC)Cl)C2CCC(CC2)N

InChI

InChI=1S/C17H24ClN3O3/c1-11(22)21(15-6-3-13(19)4-7-15)10-12-9-14(5-8-16(12)18)20-17(23)24-2/h5,8-9,13,15H,3-4,6-7,10,19H2,1-2H3,(H,20,23)