(phenylmethyl) N-[4-[[(2-azanylcyclohexyl)-cyclohexylcarbonyl-amino]methyl]phenyl]carbamate

Systemtic Name: (phenylmethyl) N-[4-[[(2-azanylcyclohexyl)-cyclohexylcarbonyl-amino]methyl]phenyl]carbamate Openeye Name: benzyl N-[4-[[(2-aminocyclohexyl)-(cyclohexanecarbonyl)amino]methyl]phenyl]carbamate CAS Name: N-[4-[[(2-aminocyclohexyl)-[cyclohexyl(oxo)methyl]amino]methyl]phenyl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[4-[[(2-aminocyclohexyl)-(cyclohexanecarbonyl)amino]methyl]phenyl]carbamate Traditional Name: N-[4-[[(2-aminocyclohexyl)-(cyclohexanecarbonyl)amino]methyl]phenyl]carbamic acid benzyl ester Formula: C28H37N3O3 MolecularWeight: 463.61168

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C(=O)N(CC2=CC=C(C=C2)NC(=O)OCC3=CC=CC=C3)C4CCCCC4N

Isomeric SMILES

C1CCC(CC1)C(=O)N(CC2=CC=C(C=C2)NC(=O)OCC3=CC=CC=C3)C4CCCCC4N

InChI

InChI=1S/C28H37N3O3/c29-25-13-7-8-14-26(25)31(27(32)23-11-5-2-6-12-23)19-21-15-17-24(18-16-21)30-28(33)34-20-22-9-3-1-4-10-22/h1,3-4,9-10,15-18,23,25-26H,2,5-8,11-14,19-20,29H2,(H,30,33)