5-(3-cyclohexylpropanoylamino)-4-(diethylaminomethyl)-2-(2-methylphenyl)benzamide

Systemtic Name: 5-(3-cyclohexylpropanoylamino)-4-(diethylaminomethyl)-2-(2-methylphenyl)benzamide Openeye Name: 5-(3-cyclohexylpropanoylamino)-4-(diethylaminomethyl)-2-(o-tolyl)benzamide CAS Name: 5-[(3-cyclohexyl-1-oxopropyl)amino]-4-(diethylaminomethyl)-2-(2-methylphenyl)benzamide IUPAC Name: 5-(3-cyclohexylpropanoylamino)-4-(diethylaminomethyl)-2-(2-methylphenyl)benzamide Traditional Name: 5-(3-cyclohexylpropanoylamino)-4-(diethylaminomethyl)-2-(o-tolyl)benzamide Formula: C28H39N3O2 MolecularWeight: 449.62816

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CC1=C(C=C(C(=C1)C2=CC=CC=C2C)C(=O)N)NC(=O)CCC3CCCCC3

Isomeric SMILES

CCN(CC)CC1=C(C=C(C(=C1)C2=CC=CC=C2C)C(=O)N)NC(=O)CCC3CCCCC3

InChI

InChI=1S/C28H39N3O2/c1-4-31(5-2)19-22-17-24(23-14-10-9-11-20(23)3)25(28(29)33)18-26(22)30-27(32)16-15-21-12-7-6-8-13-21/h9-11,14,17-18,21H,4-8,12-13,15-16,19H2,1-3H3,(H2,29,33)(H,30,32)