N-[2-[[(2-azanylcyclohexyl)-cyclopropylcarbonyl-amino]methyl]phenyl]-3,4-dimethoxy-benzamide

Systemtic Name: N-[2-[[(2-azanylcyclohexyl)-cyclopropylcarbonyl-amino]methyl]phenyl]-3,4-dimethoxy-benzamide Openeye Name: N-[2-[[(2-aminocyclohexyl)-(cyclopropanecarbonyl)amino]methyl]phenyl]-3,4-dimethoxy-benzamide CAS Name: N-[2-[[(2-aminocyclohexyl)-[cyclopropyl(oxo)methyl]amino]methyl]phenyl]-3,4-dimethoxybenzamide IUPAC Name: N-[2-[[(2-aminocyclohexyl)-(cyclopropanecarbonyl)amino]methyl]phenyl]-3,4-dimethoxybenzamide Traditional Name: N-[2-[[(2-aminocyclohexyl)-(cyclopropanecarbonyl)amino]methyl]phenyl]-3,4-dimethoxy-benzamide Formula: C26H33N3O4 MolecularWeight: 451.55792

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)NC2=CC=CC=C2CN(C3CCCCC3N)C(=O)C4CC4)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)NC2=CC=CC=C2CN(C3CCCCC3N)C(=O)C4CC4)OC

InChI

InChI=1S/C26H33N3O4/c1-32-23-14-13-18(15-24(23)33-2)25(30)28-21-9-5-3-7-19(21)16-29(26(31)17-11-12-17)22-10-6-4-8-20(22)27/h3,5,7,9,13-15,17,20,22H,4,6,8,10-12,16,27H2,1-2H3,(H,28,30)