4-butyl-N-[2-(phenylcarbonyl)-3,4-dihydro-1H-isoquinolin-7-yl]cyclohexane-1-carboxamide

Systemtic Name: 4-butyl-N-[2-(phenylcarbonyl)-3,4-dihydro-1H-isoquinolin-7-yl]cyclohexane-1-carboxamide Openeye Name: N-(2-benzoyl-3,4-dihydro-1H-isoquinolin-7-yl)-4-butyl-cyclohexanecarboxamide CAS Name: N-(2-benzoyl-3,4-dihydro-1H-isoquinolin-7-yl)-4-butyl-1-cyclohexanecarboxamide IUPAC Name: N-(2-benzoyl-3,4-dihydro-1H-isoquinolin-7-yl)-4-butylcyclohexane-1-carboxamide Traditional Name: N-(2-benzoyl-3,4-dihydro-1H-isoquinolin-7-yl)-4-butyl-cyclohexanecarboxamide Formula: C27H34N2O2 MolecularWeight: 418.57106

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1CCC(CC1)C(=O)NC2=CC3=C(CCN(C3)C(=O)C4=CC=CC=C4)C=C2

Isomeric SMILES

CCCCC1CCC(CC1)C(=O)NC2=CC3=C(CCN(C3)C(=O)C4=CC=CC=C4)C=C2

InChI

InChI=1S/C27H34N2O2/c1-2-3-7-20-10-12-22(13-11-20)26(30)28-25-15-14-21-16-17-29(19-24(21)18-25)27(31)23-8-5-4-6-9-23/h4-6,8-9,14-15,18,20,22H,2-3,7,10-13,16-17,19H2,1H3,(H,28,30)