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

Systemtic Name: methyl N-[4-[[(4-azanylcyclohexyl)-cyclohexylcarbonyl-amino]methyl]phenyl]carbamate Openeye Name: methyl N-[4-[[(4-aminocyclohexyl)-(cyclohexanecarbonyl)amino]methyl]phenyl]carbamate CAS Name: N-[4-[[(4-aminocyclohexyl)-[cyclohexyl(oxo)methyl]amino]methyl]phenyl]carbamic acid methyl ester IUPAC Name: methyl N-[4-[[(4-aminocyclohexyl)-(cyclohexanecarbonyl)amino]methyl]phenyl]carbamate Traditional Name: N-[4-[[(4-aminocyclohexyl)-(cyclohexanecarbonyl)amino]methyl]phenyl]carbamic acid methyl ester Formula: C22H33N3O3 MolecularWeight: 387.51572

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)NC1=CC=C(C=C1)CN(C2CCC(CC2)N)C(=O)C3CCCCC3

Isomeric SMILES

COC(=O)NC1=CC=C(C=C1)CN(C2CCC(CC2)N)C(=O)C3CCCCC3

InChI

InChI=1S/C22H33N3O3/c1-28-22(27)24-19-11-7-16(8-12-19)15-25(20-13-9-18(23)10-14-20)21(26)17-5-3-2-4-6-17/h7-8,11-12,17-18,20H,2-6,9-10,13-15,23H2,1H3,(H,24,27)