methyl 8-chloranyl-7-iodanyl-1,2,4,5-tetrahydro-3-benzazepine-3-carboxylate

Systemtic Name: methyl 8-chloranyl-7-iodanyl-1,2,4,5-tetrahydro-3-benzazepine-3-carboxylate Openeye Name: methyl 8-chloro-7-iodo-1,2,4,5-tetrahydro-3-benzazepine-3-carboxylate CAS Name: 8-chloro-7-iodo-1,2,4,5-tetrahydro-3-benzazepine-3-carboxylic acid methyl ester IUPAC Name: methyl 8-chloro-7-iodo-1,2,4,5-tetrahydro-3-benzazepine-3-carboxylate Traditional Name: 8-chloro-7-iodo-1,2,4,5-tetrahydro-3-benzazepine-3-carboxylic acid methyl ester Formula: C12H13ClINO2 MolecularWeight: 365.59459

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)N1CCC2=CC(=C(C=C2CC1)I)Cl

Isomeric SMILES

COC(=O)N1CCC2=CC(=C(C=C2CC1)I)Cl

InChI

InChI=1S/C12H13ClINO2/c1-17-12(16)15-4-2-8-6-10(13)11(14)7-9(8)3-5-15/h6-7H,2-5H2,1H3