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

Systemtic Name: methyl N-[3-[[(4-azanylcyclohexyl)-(phenylcarbonyl)amino]methyl]phenyl]carbamate Openeye Name: methyl N-[3-[[(4-aminocyclohexyl)-benzoyl-amino]methyl]phenyl]carbamate CAS Name: N-[3-[[(4-aminocyclohexyl)-benzoylamino]methyl]phenyl]carbamic acid methyl ester IUPAC Name: methyl N-[3-[[(4-aminocyclohexyl)-benzoylamino]methyl]phenyl]carbamate Traditional Name: N-[3-[[(4-aminocyclohexyl)-benzoyl-amino]methyl]phenyl]carbamic acid methyl ester Formula: C22H27N3O3 MolecularWeight: 381.46808

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)NC1=CC=CC(=C1)CN(C2CCC(CC2)N)C(=O)C3=CC=CC=C3

Isomeric SMILES

COC(=O)NC1=CC=CC(=C1)CN(C2CCC(CC2)N)C(=O)C3=CC=CC=C3

InChI

InChI=1S/C22H27N3O3/c1-28-22(27)24-19-9-5-6-16(14-19)15-25(20-12-10-18(23)11-13-20)21(26)17-7-3-2-4-8-17/h2-9,14,18,20H,10-13,15,23H2,1H3,(H,24,27)