ethyl 2-methyl-9-(pyridin-3-ylmethyl)-6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridine-3-carboxylate

Systemtic Name: ethyl 2-methyl-9-(pyridin-3-ylmethyl)-6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridine-3-carboxylate Openeye Name: ethyl 2-methyl-9-(3-pyridylmethyl)-6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridine-3-carboxylate CAS Name: 2-methyl-9-(3-pyridinylmethyl)-6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridine-3-carboxylic acid ethyl ester IUPAC Name: ethyl 2-methyl-9-(pyridin-3-ylmethyl)-6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridine-3-carboxylate Traditional Name: 2-methyl-9-(3-pyridylmethyl)-6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridine-3-carboxylic acid ethyl ester Formula: C20H24N2O2 MolecularWeight: 324.41676

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H24N2O2/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/h6-7,10,12-13,16H,3-5,8-9,11H2,1-2H3