dimethyl 2,7-dimethyl-5-phenyl-4,5-dihydro-3H-azepine-3,6-dicarboxylate

Systemtic Name: dimethyl 2,7-dimethyl-5-phenyl-4,5-dihydro-3H-azepine-3,6-dicarboxylate Openeye Name: dimethyl 2,7-dimethyl-5-phenyl-4,5-dihydro-3H-azepine-3,6-dicarboxylate CAS Name: 2,7-dimethyl-5-phenyl-4,5-dihydro-3H-azepine-3,6-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 2,7-dimethyl-5-phenyl-4,5-dihydro-3H-azepine-3,6-dicarboxylate Traditional Name: 2,7-dimethyl-5-phenyl-4,5-dihydro-3H-azepine-3,6-dicarboxylic acid dimethyl ester Formula: C18H21NO4 MolecularWeight: 315.36364

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C(C(CC1C(=O)OC)C2=CC=CC=C2)C(=O)OC)C

Isomeric SMILES

CC1=NC(=C(C(CC1C(=O)OC)C2=CC=CC=C2)C(=O)OC)C

InChI

InChI=1S/C18H21NO4/c1-11-14(17(20)22-3)10-15(13-8-6-5-7-9-13)16(12(2)19-11)18(21)23-4/h5-9,14-15H,10H2,1-4H3