ethyl 4-chloranyl-5-methanoyl-2,3,6,7-tetrahydroazepine-1-carboxylate

Systemtic Name: ethyl 4-chloranyl-5-methanoyl-2,3,6,7-tetrahydroazepine-1-carboxylate Openeye Name: ethyl 4-chloro-5-formyl-2,3,6,7-tetrahydroazepine-1-carboxylate CAS Name: 4-chloro-5-formyl-2,3,6,7-tetrahydroazepine-1-carboxylic acid ethyl ester IUPAC Name: ethyl 4-chloro-5-formyl-2,3,6,7-tetrahydroazepine-1-carboxylate Traditional Name: 4-chloro-5-formyl-2,3,6,7-tetrahydroazepine-1-carboxylic acid ethyl ester Formula: C10H14ClNO3 MolecularWeight: 231.67606

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCC(=C(CC1)Cl)C=O

Isomeric SMILES

CCOC(=O)N1CCC(=C(CC1)Cl)C=O

InChI

InChI=1S/C10H14ClNO3/c1-2-15-10(14)12-5-3-8(7-13)9(11)4-6-12/h7H,2-6H2,1H3