methyl 2-chloranyl-3,6-dimethyl-5,7,8,9-tetrahydropyrido[3,2-c]azepine-9-carboxylate

Systemtic Name: methyl 2-chloranyl-3,6-dimethyl-5,7,8,9-tetrahydropyrido[3,2-c]azepine-9-carboxylate Openeye Name: methyl 2-chloro-3,6-dimethyl-5,7,8,9-tetrahydropyrido[3,2-c]azepine-9-carboxylate CAS Name: 2-chloro-3,6-dimethyl-5,7,8,9-tetrahydropyrido[3,2-c]azepine-9-carboxylic acid methyl ester IUPAC Name: methyl 2-chloro-3,6-dimethyl-5,7,8,9-tetrahydropyrido[3,2-c]azepine-9-carboxylate Traditional Name: 2-chloro-3,6-dimethyl-5,7,8,9-tetrahydropyrid[3,2-c]azepine-9-carboxylic acid methyl ester Formula: C13H17ClN2O2 MolecularWeight: 268.73928

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C2C(CCN(CC2=C1)C)C(=O)OC)Cl

Isomeric SMILES

CC1=C(N=C2C(CCN(CC2=C1)C)C(=O)OC)Cl

InChI

InChI=1S/C13H17ClN2O2/c1-8-6-9-7-16(2)5-4-10(13(17)18-3)11(9)15-12(8)14/h6,10H,4-5,7H2,1-3H3