methyl 6-acetamido-7-chloranyl-2,2-dimethyl-4,5-dihydro-3H-1-benzoxepine-9-carboxylate

Systemtic Name: methyl 6-acetamido-7-chloranyl-2,2-dimethyl-4,5-dihydro-3H-1-benzoxepine-9-carboxylate Openeye Name: methyl 6-acetamido-7-chloro-2,2-dimethyl-4,5-dihydro-3H-1-benzoxepine-9-carboxylate CAS Name: 6-acetamido-7-chloro-2,2-dimethyl-4,5-dihydro-3H-1-benzoxepin-9-carboxylic acid methyl ester IUPAC Name: methyl 6-acetamido-7-chloro-2,2-dimethyl-4,5-dihydro-3H-1-benzoxepine-9-carboxylate Traditional Name: 6-acetamido-7-chloro-2,2-dimethyl-4,5-dihydro-3H-1-benzoxepin-9-carboxylic acid methyl ester Formula: C16H20ClNO4 MolecularWeight: 325.7873

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=C(C=C(C2=C1CCCC(O2)(C)C)C(=O)OC)Cl

Isomeric SMILES

CC(=O)NC1=C(C=C(C2=C1CCCC(O2)(C)C)C(=O)OC)Cl

InChI

InChI=1S/C16H20ClNO4/c1-9(19)18-13-10-6-5-7-16(2,3)22-14(10)11(8-12(13)17)15(20)21-4/h8H,5-7H2,1-4H3,(H,18,19)