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

Systemtic Name: N-[4-[[(2-azanylcyclohexyl)-cyclopropylcarbonyl-amino]methyl]phenyl]-3,4-dimethoxy-benzamide Openeye Name: N-[4-[[(2-aminocyclohexyl)-(cyclopropanecarbonyl)amino]methyl]phenyl]-3,4-dimethoxy-benzamide CAS Name: N-[4-[[(2-aminocyclohexyl)-[cyclopropyl(oxo)methyl]amino]methyl]phenyl]-3,4-dimethoxybenzamide IUPAC Name: N-[4-[[(2-aminocyclohexyl)-(cyclopropanecarbonyl)amino]methyl]phenyl]-3,4-dimethoxybenzamide Traditional Name: N-[4-[[(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=C(C=C2)CN(C3CCCCC3N)C(=O)C4CC4)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)NC2=CC=C(C=C2)CN(C3CCCCC3N)C(=O)C4CC4)OC

InChI

InChI=1S/C26H33N3O4/c1-32-23-14-11-19(15-24(23)33-2)25(30)28-20-12-7-17(8-13-20)16-29(26(31)18-9-10-18)22-6-4-3-5-21(22)27/h7-8,11-15,18,21-22H,3-6,9-10,16,27H2,1-2H3,(H,28,30)