diethyl 5-phenyl-2,3,6,7-tetrahydroazepine-1,4-dicarboxylate

Systemtic Name: diethyl 5-phenyl-2,3,6,7-tetrahydroazepine-1,4-dicarboxylate Openeye Name: diethyl 5-phenyl-2,3,6,7-tetrahydroazepine-1,4-dicarboxylate CAS Name: 5-phenyl-2,3,6,7-tetrahydroazepine-1,4-dicarboxylic acid diethyl ester IUPAC Name: diethyl 5-phenyl-2,3,6,7-tetrahydroazepine-1,4-dicarboxylate Traditional Name: 5-phenyl-2,3,6,7-tetrahydroazepine-1,4-dicarboxylic acid diethyl ester Formula: C18H23NO4 MolecularWeight: 317.37952

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(CCN(CC1)C(=O)OCC)C2=CC=CC=C2

Isomeric SMILES

CCOC(=O)C1=C(CCN(CC1)C(=O)OCC)C2=CC=CC=C2

InChI

InChI=1S/C18H23NO4/c1-3-22-17(20)16-11-13-19(18(21)23-4-2)12-10-15(16)14-8-6-5-7-9-14/h5-9H,3-4,10-13H2,1-2H3