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

Systemtic Name: 4-butyl-N-(2-propanoyl-3,4-dihydro-1H-isoquinolin-7-yl)cyclohexane-1-carboxamide Openeye Name: 4-butyl-N-(2-propanoyl-3,4-dihydro-1H-isoquinolin-7-yl)cyclohexanecarboxamide CAS Name: 4-butyl-N-[2-(1-oxopropyl)-3,4-dihydro-1H-isoquinolin-7-yl]-1-cyclohexanecarboxamide IUPAC Name: 4-butyl-N-(2-propanoyl-3,4-dihydro-1H-isoquinolin-7-yl)cyclohexane-1-carboxamide Traditional Name: 4-butyl-N-(2-propionyl-3,4-dihydro-1H-isoquinolin-7-yl)cyclohexanecarboxamide Formula: C23H34N2O2 MolecularWeight: 370.52826

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H34N2O2/c1-3-5-6-17-7-9-19(10-8-17)23(27)24-21-12-11-18-13-14-25(22(26)4-2)16-20(18)15-21/h11-12,15,17,19H,3-10,13-14,16H2,1-2H3,(H,24,27)