ethyl (9E)-2-methyl-9-(pyridin-3-ylmethylidene)-5,6,7,8-tetrahydrocyclohepta[b]pyridine-3-carboxylate

Systemtic Name: ethyl (9E)-2-methyl-9-(pyridin-3-ylmethylidene)-5,6,7,8-tetrahydrocyclohepta[b]pyridine-3-carboxylate Openeye Name: ethyl (9E)-2-methyl-9-(3-pyridylmethylene)-5,6,7,8-tetrahydrocyclohepta[b]pyridine-3-carboxylate CAS Name: (9E)-2-methyl-9-(3-pyridinylmethylidene)-5,6,7,8-tetrahydrocyclohepta[b]pyridine-3-carboxylic acid ethyl ester IUPAC Name: ethyl (9E)-2-methyl-9-(pyridin-3-ylmethylidene)-5,6,7,8-tetrahydrocyclohepta[b]pyridine-3-carboxylate Traditional Name: (9E)-2-methyl-9-(3-pyridylmethylene)-5,6,7,8-tetrahydrocyclohepta[b]pyridine-3-carboxylic acid ethyl ester Formula: C20H22N2O2 MolecularWeight: 322.40088

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC2=C(C(=CC3=CN=CC=C3)CCCC2)N=C1C

Isomeric SMILES

CCOC(=O)C1=CC2=C(/C(=C/C3=CN=CC=C3)/CCCC2)N=C1C

InChI

InChI=1S/C20H22N2O2/c1-3-24-20(23)18-12-17-9-5-4-8-16(19(17)22-14(18)2)11-15-7-6-10-21-13-15/h6-7,10-13H,3-5,8-9H2,1-2H3/b16-11+