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methyl 1-(phenylcarbonyl)-2,3,4,7-tetrahydroazepine-2-carboxylate

methyl 1-(phenylcarbonyl)-2,3,4,7-tetrahydroazepine-2-carboxylate

Systemtic Name:methyl 1-(phenylcarbonyl)-2,3,4,7-tetrahydroazepine-2-carboxylate
Openeye Name:methyl 1-benzoyl-2,3,4,7-tetrahydroazepine-2-carboxylate
CAS Name:1-benzoyl-2,3,4,7-tetrahydroazepine-2-carboxylic acid methyl ester
IUPAC Name:methyl 1-benzoyl-2,3,4,7-tetrahydroazepine-2-carboxylate
Traditional Name:1-benzoyl-2,3,4,7-tetrahydroazepine-2-carboxylic acid methyl ester
Formula: C15H17NO3
MolecularWeight: 259.30038
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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CCC=CCN1C(=O)C2=CC=CC=C2


Isomeric SMILES

COC(=O)C1CCC=CCN1C(=O)C2=CC=CC=C2


InChI

InChI=1S/C15H17NO3/c1-19-15(18)13-10-6-3-7-11-16(13)14(17)12-8-4-2-5-9-12/h2-5,7-9,13H,6,10-11H2,1H3


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