N-[(E)-[3-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-4-methoxy-phenyl]methylideneamino]pyridine-3-carboxamide

Systemtic Name: N-[(E)-[3-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-4-methoxy-phenyl]methylideneamino]pyridine-3-carboxamide Openeye Name: N-[(E)-[3-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-4-methoxy-phenyl]methyleneamino]pyridine-3-carboxamide CAS Name: N-[(E)-[3-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-4-methoxyphenyl]methylideneamino]-3-pyridinecarboxamide IUPAC Name: N-[(E)-[3-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-4-methoxyphenyl]methylideneamino]pyridine-3-carboxamide Traditional Name: N-[(E)-[3-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-4-methoxy-benzylidene]amino]nicotinamide Formula: C24H24N4O2 MolecularWeight: 400.47296

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C=NNC(=O)C2=CN=CC=C2)CN3CCC4=CC=CC=C4C3

Isomeric SMILES

COC1=C(C=C(C=C1)/C=N/NC(=O)C2=CN=CC=C2)CN3CCC4=CC=CC=C4C3

InChI

InChI=1S/C24H24N4O2/c1-30-23-9-8-18(14-26-27-24(29)20-7-4-11-25-15-20)13-22(23)17-28-12-10-19-5-2-3-6-21(19)16-28/h2-9,11,13-15H,10,12,16-17H2,1H3,(H,27,29)/b26-14+