7-(4-methylphenyl)-N-(4-pyridin-2-ylphenyl)-2,3-dihydro-1-benzoxepine-4-carboxamide

Systemtic Name: 7-(4-methylphenyl)-N-(4-pyridin-2-ylphenyl)-2,3-dihydro-1-benzoxepine-4-carboxamide Openeye Name: 7-(p-tolyl)-N-[4-(2-pyridyl)phenyl]-2,3-dihydro-1-benzoxepine-4-carboxamide CAS Name: 7-(4-methylphenyl)-N-[4-(2-pyridinyl)phenyl]-2,3-dihydro-1-benzoxepin-4-carboxamide IUPAC Name: 7-(4-methylphenyl)-N-(4-pyridin-2-ylphenyl)-2,3-dihydro-1-benzoxepine-4-carboxamide Traditional Name: 7-(p-tolyl)-N-[4-(2-pyridyl)phenyl]-2,3-dihydro-1-benzoxepin-4-carboxamide Formula: C29H24N2O2 MolecularWeight: 432.51306

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CC3=C(C=C2)OCCC(=C3)C(=O)NC4=CC=C(C=C4)C5=CC=CC=N5

Isomeric SMILES

CC1=CC=C(C=C1)C2=CC3=C(C=C2)OCCC(=C3)C(=O)NC4=CC=C(C=C4)C5=CC=CC=N5

InChI

InChI=1S/C29H24N2O2/c1-20-5-7-21(8-6-20)23-11-14-28-25(18-23)19-24(15-17-33-28)29(32)31-26-12-9-22(10-13-26)27-4-2-3-16-30-27/h2-14,16,18-19H,15,17H2,1H3,(H,31,32)