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

Systemtic Name: 7-(4-ethoxyphenyl)-N-[4-(hydroxymethyl)phenyl]-2,3-dihydro-1-benzoxepine-4-carboxamide Openeye Name: 7-(4-ethoxyphenyl)-N-[4-(hydroxymethyl)phenyl]-2,3-dihydro-1-benzoxepine-4-carboxamide CAS Name: 7-(4-ethoxyphenyl)-N-[4-(hydroxymethyl)phenyl]-2,3-dihydro-1-benzoxepin-4-carboxamide IUPAC Name: 7-(4-ethoxyphenyl)-N-[4-(hydroxymethyl)phenyl]-2,3-dihydro-1-benzoxepine-4-carboxamide Traditional Name: N-(4-methylolphenyl)-7-p-phenetyl-2,3-dihydro-1-benzoxepin-4-carboxamide Formula: C26H25NO4 MolecularWeight: 415.481

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2=CC3=C(C=C2)OCCC(=C3)C(=O)NC4=CC=C(C=C4)CO

Isomeric SMILES

CCOC1=CC=C(C=C1)C2=CC3=C(C=C2)OCCC(=C3)C(=O)NC4=CC=C(C=C4)CO

InChI

InChI=1S/C26H25NO4/c1-2-30-24-10-5-19(6-11-24)20-7-12-25-22(15-20)16-21(13-14-31-25)26(29)27-23-8-3-18(17-28)4-9-23/h3-12,15-16,28H,2,13-14,17H2,1H3,(H,27,29)