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

Systemtic Name: methyl 6-acetamido-9-methanoyl-2,3,4,5-tetrahydro-1-benzoxepine-2-carboxylate Openeye Name: methyl 6-acetamido-9-formyl-2,3,4,5-tetrahydro-1-benzoxepine-2-carboxylate CAS Name: 6-acetamido-9-formyl-2,3,4,5-tetrahydro-1-benzoxepin-2-carboxylic acid methyl ester IUPAC Name: methyl 6-acetamido-9-formyl-2,3,4,5-tetrahydro-1-benzoxepine-2-carboxylate Traditional Name: 6-acetamido-9-formyl-2,3,4,5-tetrahydro-1-benzoxepin-2-carboxylic acid methyl ester Formula: C15H17NO5 MolecularWeight: 291.29918

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=C2CCCC(OC2=C(C=C1)C=O)C(=O)OC

Isomeric SMILES

CC(=O)NC1=C2CCCC(OC2=C(C=C1)C=O)C(=O)OC

InChI

InChI=1S/C15H17NO5/c1-9(18)16-12-7-6-10(8-17)14-11(12)4-3-5-13(21-14)15(19)20-2/h6-8,13H,3-5H2,1-2H3,(H,16,18)