N-[4-[[(4-azanylcyclohexyl)-cyclopropylcarbonyl-amino]methyl]phenyl]-2-methoxy-benzamide

Systemtic Name: N-[4-[[(4-azanylcyclohexyl)-cyclopropylcarbonyl-amino]methyl]phenyl]-2-methoxy-benzamide Openeye Name: N-[4-[[(4-aminocyclohexyl)-(cyclopropanecarbonyl)amino]methyl]phenyl]-2-methoxy-benzamide CAS Name: N-[4-[[(4-aminocyclohexyl)-[cyclopropyl(oxo)methyl]amino]methyl]phenyl]-2-methoxybenzamide IUPAC Name: N-[4-[[(4-aminocyclohexyl)-(cyclopropanecarbonyl)amino]methyl]phenyl]-2-methoxybenzamide Traditional Name: N-[4-[[(4-aminocyclohexyl)-(cyclopropanecarbonyl)amino]methyl]phenyl]-2-methoxy-benzamide Formula: C25H31N3O3 MolecularWeight: 421.53194

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C(=O)NC2=CC=C(C=C2)CN(C3CCC(CC3)N)C(=O)C4CC4

Isomeric SMILES

COC1=CC=CC=C1C(=O)NC2=CC=C(C=C2)CN(C3CCC(CC3)N)C(=O)C4CC4

InChI

InChI=1S/C25H31N3O3/c1-31-23-5-3-2-4-22(23)24(29)27-20-12-6-17(7-13-20)16-28(25(30)18-8-9-18)21-14-10-19(26)11-15-21/h2-7,12-13,18-19,21H,8-11,14-16,26H2,1H3,(H,27,29)