1-oxidanylidene-N-(4-pentylphenyl)-2H-isoquinoline-3-carboxamide

Systemtic Name: 1-oxidanylidene-N-(4-pentylphenyl)-2H-isoquinoline-3-carboxamide Openeye Name: 1-oxo-N-(4-pentylphenyl)-2H-isoquinoline-3-carboxamide CAS Name: 1-oxo-N-(4-pentylphenyl)-2H-isoquinoline-3-carboxamide IUPAC Name: 1-oxo-N-(4-pentylphenyl)-2H-isoquinoline-3-carboxamide Traditional Name: N-(4-amylphenyl)-1-keto-2H-isoquinoline-3-carboxamide Formula: C21H22N2O2 MolecularWeight: 334.41158

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC=C(C=C1)NC(=O)C2=CC3=CC=CC=C3C(=O)N2

Isomeric SMILES

CCCCCC1=CC=C(C=C1)NC(=O)C2=CC3=CC=CC=C3C(=O)N2

InChI

InChI=1S/C21H22N2O2/c1-2-3-4-7-15-10-12-17(13-11-15)22-21(25)19-14-16-8-5-6-9-18(16)20(24)23-19/h5-6,8-14H,2-4,7H2,1H3,(H,22,25)(H,23,24)