N-[2-(cyclohexen-1-ylcarbonyl)-3,4-dihydro-1H-isoquinolin-7-yl]pyridine-4-carboxamide

Systemtic Name: N-[2-(cyclohexen-1-ylcarbonyl)-3,4-dihydro-1H-isoquinolin-7-yl]pyridine-4-carboxamide Openeye Name: N-[2-(cyclohexene-1-carbonyl)-3,4-dihydro-1H-isoquinolin-7-yl]pyridine-4-carboxamide CAS Name: N-[2-[1-cyclohexenyl(oxo)methyl]-3,4-dihydro-1H-isoquinolin-7-yl]-4-pyridinecarboxamide IUPAC Name: N-[2-(cyclohexene-1-carbonyl)-3,4-dihydro-1H-isoquinolin-7-yl]pyridine-4-carboxamide Traditional Name: N-[2-(cyclohexene-1-carbonyl)-3,4-dihydro-1H-isoquinolin-7-yl]isonicotinamide Formula: C22H23N3O2 MolecularWeight: 361.43692

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=CC1)C(=O)N2CCC3=C(C2)C=C(C=C3)NC(=O)C4=CC=NC=C4

Isomeric SMILES

C1CCC(=CC1)C(=O)N2CCC3=C(C2)C=C(C=C3)NC(=O)C4=CC=NC=C4

InChI

InChI=1S/C22H23N3O2/c26-21(17-8-11-23-12-9-17)24-20-7-6-16-10-13-25(15-19(16)14-20)22(27)18-4-2-1-3-5-18/h4,6-9,11-12,14H,1-3,5,10,13,15H2,(H,24,26)