5-(3,4-dihydro-1H-isoquinolin-2-ylcarbonyl)-4-oxidanylidene-1-(phenylmethyl)-N-prop-2-enyl-pyridine-3-carboxamide

Systemtic Name: 5-(3,4-dihydro-1H-isoquinolin-2-ylcarbonyl)-4-oxidanylidene-1-(phenylmethyl)-N-prop-2-enyl-pyridine-3-carboxamide Openeye Name: N-allyl-1-benzyl-5-(3,4-dihydro-1H-isoquinoline-2-carbonyl)-4-oxo-pyridine-3-carboxamide CAS Name: 5-[3,4-dihydro-1H-isoquinolin-2-yl(oxo)methyl]-4-oxo-1-(phenylmethyl)-N-prop-2-enyl-3-pyridinecarboxamide IUPAC Name: 1-benzyl-5-(3,4-dihydro-1H-isoquinoline-2-carbonyl)-4-oxo-N-prop-2-enylpyridine-3-carboxamide Traditional Name: N-allyl-1-benzyl-5-(3,4-dihydro-1H-isoquinoline-2-carbonyl)-4-keto-nicotinamide Formula: C26H25N3O3 MolecularWeight: 427.495

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Descriptors Computed from Structure

Canonical SMILES:

C=CCNC(=O)C1=CN(C=C(C1=O)C(=O)N2CCC3=CC=CC=C3C2)CC4=CC=CC=C4

Isomeric SMILES

C=CCNC(=O)C1=CN(C=C(C1=O)C(=O)N2CCC3=CC=CC=C3C2)CC4=CC=CC=C4

InChI

InChI=1S/C26H25N3O3/c1-2-13-27-25(31)22-17-28(15-19-8-4-3-5-9-19)18-23(24(22)30)26(32)29-14-12-20-10-6-7-11-21(20)16-29/h2-11,17-18H,1,12-16H2,(H,27,31)