methyl 6-acetamido-7-chloranyl-2,3,4,5-tetrahydro-1-benzoxepine-9-carboxylate

Systemtic Name: methyl 6-acetamido-7-chloranyl-2,3,4,5-tetrahydro-1-benzoxepine-9-carboxylate Openeye Name: methyl 6-acetamido-7-chloro-2,3,4,5-tetrahydro-1-benzoxepine-9-carboxylate CAS Name: 6-acetamido-7-chloro-2,3,4,5-tetrahydro-1-benzoxepin-9-carboxylic acid methyl ester IUPAC Name: methyl 6-acetamido-7-chloro-2,3,4,5-tetrahydro-1-benzoxepine-9-carboxylate Traditional Name: 6-acetamido-7-chloro-2,3,4,5-tetrahydro-1-benzoxepin-9-carboxylic acid methyl ester Formula: C14H16ClNO4 MolecularWeight: 297.73414

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=C(C=C(C2=C1CCCCO2)C(=O)OC)Cl

Isomeric SMILES

CC(=O)NC1=C(C=C(C2=C1CCCCO2)C(=O)OC)Cl

InChI

InChI=1S/C14H16ClNO4/c1-8(17)16-12-9-5-3-4-6-20-13(9)10(7-11(12)15)14(18)19-2/h7H,3-6H2,1-2H3,(H,16,17)