(4E)-4-(6-methoxy-1H-pyridin-2-ylidene)-2-[(phenethylamino)methyl]cyclohexa-2,5-dien-1-one

Systemtic Name: (4E)-4-(6-methoxy-1H-pyridin-2-ylidene)-2-[(phenethylamino)methyl]cyclohexa-2,5-dien-1-one Openeye Name: (4E)-4-(6-methoxy-1H-pyridin-2-ylidene)-2-[(phenethylamino)methyl]cyclohexa-2,5-dien-1-one CAS Name: (4E)-4-(6-methoxy-1H-pyridin-2-ylidene)-2-[(phenethylamino)methyl]-1-cyclohexa-2,5-dienone IUPAC Name: (4E)-4-(6-methoxy-1H-pyridin-2-ylidene)-2-[(phenethylamino)methyl]cyclohexa-2,5-dien-1-one Traditional Name: (4E)-4-(6-methoxy-1H-pyridin-2-ylidene)-2-[(phenethylamino)methyl]cyclohexa-2,5-dien-1-one Formula: C21H22N2O2 MolecularWeight: 334.41158

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C2C=CC(=O)C(=C2)CNCCC3=CC=CC=C3)N1

Isomeric SMILES

COC1=CC=C/C(=C\2/C=CC(=O)C(=C2)CNCCC3=CC=CC=C3)/N1

InChI

InChI=1S/C21H22N2O2/c1-25-21-9-5-8-19(23-21)17-10-11-20(24)18(14-17)15-22-13-12-16-6-3-2-4-7-16/h2-11,14,22-23H,12-13,15H2,1H3/b19-17+