N,N-dimethyl-2-[4-[4-(4-methylphenyl)-2,3-dihydro-1-benzoxepin-5-yl]phenoxy]ethanamine

Systemtic Name: N,N-dimethyl-2-[4-[4-(4-methylphenyl)-2,3-dihydro-1-benzoxepin-5-yl]phenoxy]ethanamine Openeye Name: N,N-dimethyl-2-[4-[4-(p-tolyl)-2,3-dihydro-1-benzoxepin-5-yl]phenoxy]ethanamine CAS Name: N,N-dimethyl-2-[4-[4-(4-methylphenyl)-2,3-dihydro-1-benzoxepin-5-yl]phenoxy]ethanamine IUPAC Name: N,N-dimethyl-2-[4-[4-(4-methylphenyl)-2,3-dihydro-1-benzoxepin-5-yl]phenoxy]ethanamine Traditional Name: dimethyl-[2-[4-[4-(p-tolyl)-2,3-dihydro-1-benzoxepin-5-yl]phenoxy]ethyl]amine Formula: C27H29NO2 MolecularWeight: 399.52466

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=C(C3=CC=CC=C3OCC2)C4=CC=C(C=C4)OCCN(C)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=C(C3=CC=CC=C3OCC2)C4=CC=C(C=C4)OCCN(C)C

InChI

InChI=1S/C27H29NO2/c1-20-8-10-21(11-9-20)24-16-18-30-26-7-5-4-6-25(26)27(24)22-12-14-23(15-13-22)29-19-17-28(2)3/h4-15H,16-19H2,1-3H3