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

Systemtic Name: (phenylmethyl) N-[4-[[(2-azanylcyclohexyl)-cyclopropylcarbonyl-amino]methyl]phenyl]carbamate Openeye Name: benzyl N-[4-[[(2-aminocyclohexyl)-(cyclopropanecarbonyl)amino]methyl]phenyl]carbamate CAS Name: N-[4-[[(2-aminocyclohexyl)-[cyclopropyl(oxo)methyl]amino]methyl]phenyl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[4-[[(2-aminocyclohexyl)-(cyclopropanecarbonyl)amino]methyl]phenyl]carbamate Traditional Name: N-[4-[[(2-aminocyclohexyl)-(cyclopropanecarbonyl)amino]methyl]phenyl]carbamic acid benzyl ester Formula: C25H31N3O3 MolecularWeight: 421.53194

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C(C1)N)N(CC2=CC=C(C=C2)NC(=O)OCC3=CC=CC=C3)C(=O)C4CC4

Isomeric SMILES

C1CCC(C(C1)N)N(CC2=CC=C(C=C2)NC(=O)OCC3=CC=CC=C3)C(=O)C4CC4

InChI

InChI=1S/C25H31N3O3/c26-22-8-4-5-9-23(22)28(24(29)20-12-13-20)16-18-10-14-21(15-11-18)27-25(30)31-17-19-6-2-1-3-7-19/h1-3,6-7,10-11,14-15,20,22-23H,4-5,8-9,12-13,16-17,26H2,(H,27,30)