N-methyl-N-[[7-(4-methylphenyl)-2-(phenoxymethyl)-2,3-dihydro-1-benzoxepin-3-yl]methyl]oxan-4-amine

Systemtic Name: N-methyl-N-[[7-(4-methylphenyl)-2-(phenoxymethyl)-2,3-dihydro-1-benzoxepin-3-yl]methyl]oxan-4-amine Openeye Name: N-methyl-N-[[2-(phenoxymethyl)-7-(p-tolyl)-2,3-dihydro-1-benzoxepin-3-yl]methyl]tetrahydropyran-4-amine CAS Name: N-methyl-N-[[7-(4-methylphenyl)-2-(phenoxymethyl)-2,3-dihydro-1-benzoxepin-3-yl]methyl]-4-oxanamine IUPAC Name: N-methyl-N-[[7-(4-methylphenyl)-2-(phenoxymethyl)-2,3-dihydro-1-benzoxepin-3-yl]methyl]oxan-4-amine Traditional Name: methyl-[[2-(phenoxymethyl)-7-(p-tolyl)-2,3-dihydro-1-benzoxepin-3-yl]methyl]-tetrahydropyran-4-yl-amine Formula: C31H35NO3 MolecularWeight: 469.6145

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CC3=C(C=C2)OC(C(C=C3)CN(C)C4CCOCC4)COC5=CC=CC=C5

Isomeric SMILES

CC1=CC=C(C=C1)C2=CC3=C(C=C2)OC(C(C=C3)CN(C)C4CCOCC4)COC5=CC=CC=C5

InChI

InChI=1S/C31H35NO3/c1-23-8-10-24(11-9-23)25-14-15-30-26(20-25)12-13-27(21-32(2)28-16-18-33-19-17-28)31(35-30)22-34-29-6-4-3-5-7-29/h3-15,20,27-28,31H,16-19,21-22H2,1-2H3