N-(2-azanylcyclohexyl)-3-[(3,4-dimethoxyphenyl)carbonylamino]-4-(pyrrolidin-1-ylmethyl)benzamide

Systemtic Name: N-(2-azanylcyclohexyl)-3-[(3,4-dimethoxyphenyl)carbonylamino]-4-(pyrrolidin-1-ylmethyl)benzamide Openeye Name: N-(2-aminocyclohexyl)-3-[(3,4-dimethoxybenzoyl)amino]-4-(pyrrolidin-1-ylmethyl)benzamide CAS Name: N-(2-aminocyclohexyl)-3-[[(3,4-dimethoxyphenyl)-oxomethyl]amino]-4-(1-pyrrolidinylmethyl)benzamide IUPAC Name: N-(2-aminocyclohexyl)-3-[(3,4-dimethoxybenzoyl)amino]-4-(pyrrolidin-1-ylmethyl)benzamide Traditional Name: N-(2-aminocyclohexyl)-4-(pyrrolidinomethyl)-3-(veratroylamino)benzamide Formula: C27H36N4O4 MolecularWeight: 480.59914

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)NC2=C(C=CC(=C2)C(=O)NC3CCCCC3N)CN4CCCC4)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)NC2=C(C=CC(=C2)C(=O)NC3CCCCC3N)CN4CCCC4)OC

InChI

InChI=1S/C27H36N4O4/c1-34-24-12-11-19(16-25(24)35-2)27(33)30-23-15-18(9-10-20(23)17-31-13-5-6-14-31)26(32)29-22-8-4-3-7-21(22)28/h9-12,15-16,21-22H,3-8,13-14,17,28H2,1-2H3,(H,29,32)(H,30,33)