N-[4-(hydroxymethyl)phenyl]-7-(4-methylphenyl)-2,3-dihydro-1-benzoxepine-4-carboxamide

Systemtic Name: N-[4-(hydroxymethyl)phenyl]-7-(4-methylphenyl)-2,3-dihydro-1-benzoxepine-4-carboxamide Openeye Name: N-[4-(hydroxymethyl)phenyl]-7-(p-tolyl)-2,3-dihydro-1-benzoxepine-4-carboxamide CAS Name: N-[4-(hydroxymethyl)phenyl]-7-(4-methylphenyl)-2,3-dihydro-1-benzoxepin-4-carboxamide IUPAC Name: N-[4-(hydroxymethyl)phenyl]-7-(4-methylphenyl)-2,3-dihydro-1-benzoxepine-4-carboxamide Traditional Name: N-(4-methylolphenyl)-7-(p-tolyl)-2,3-dihydro-1-benzoxepin-4-carboxamide Formula: C25H23NO3 MolecularWeight: 385.45502

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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)CO

Isomeric SMILES

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

InChI

InChI=1S/C25H23NO3/c1-17-2-6-19(7-3-17)20-8-11-24-22(14-20)15-21(12-13-29-24)25(28)26-23-9-4-18(16-27)5-10-23/h2-11,14-15,27H,12-13,16H2,1H3,(H,26,28)