methyl 11-(pyridin-3-ylmethylimino)-6H-benzo[c][1]benzoxepine-2-carboxylate

Systemtic Name: methyl 11-(pyridin-3-ylmethylimino)-6H-benzo[c][1]benzoxepine-2-carboxylate Openeye Name: methyl 11-(3-pyridylmethylimino)-6H-benzo[c][1]benzoxepine-2-carboxylate CAS Name: 11-(3-pyridinylmethylimino)-6H-benzo[c][1]benzoxepin-2-carboxylic acid methyl ester IUPAC Name: methyl 11-(pyridin-3-ylmethylimino)-6H-benzo[c][1]benzoxepine-2-carboxylate Traditional Name: 11-(3-pyridylmethylimino)-6H-benzo[c][1]benzoxepin-2-carboxylic acid methyl ester Formula: C22H18N2O3 MolecularWeight: 358.38992

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC2=C(C=C1)OCC3=CC=CC=C3C2=NCC4=CN=CC=C4

Isomeric SMILES

COC(=O)C1=CC2=C(C=C1)OCC3=CC=CC=C3C2=NCC4=CN=CC=C4

InChI

InChI=1S/C22H18N2O3/c1-26-22(25)16-8-9-20-19(11-16)21(24-13-15-5-4-10-23-12-15)18-7-3-2-6-17(18)14-27-20/h2-12H,13-14H2,1H3