4-(1,3-benzodioxol-5-ylmethyl)-7-(3,4-dihydronaphthalen-2-yl)-3,5-dihydro-2H-1,4-benzoxazepine

Systemtic Name: 4-(1,3-benzodioxol-5-ylmethyl)-7-(3,4-dihydronaphthalen-2-yl)-3,5-dihydro-2H-1,4-benzoxazepine Openeye Name: 4-(1,3-benzodioxol-5-ylmethyl)-7-(3,4-dihydronaphthalen-2-yl)-3,5-dihydro-2H-1,4-benzoxazepine CAS Name: 4-(1,3-benzodioxol-5-ylmethyl)-7-(3,4-dihydronaphthalen-2-yl)-3,5-dihydro-2H-1,4-benzoxazepine IUPAC Name: 4-(1,3-benzodioxol-5-ylmethyl)-7-(3,4-dihydronaphthalen-2-yl)-3,5-dihydro-2H-1,4-benzoxazepine Traditional Name: 7-(3,4-dihydronaphthalen-2-yl)-4-piperonyl-3,5-dihydro-2H-1,4-benzoxazepine Formula: C27H25NO3 MolecularWeight: 411.4923

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=CC2=CC=CC=C21)C3=CC4=C(C=C3)OCCN(C4)CC5=CC6=C(C=C5)OCO6

Isomeric SMILES

C1CC(=CC2=CC=CC=C21)C3=CC4=C(C=C3)OCCN(C4)CC5=CC6=C(C=C5)OCO6

InChI

InChI=1S/C27H25NO3/c1-2-4-21-14-22(7-6-20(21)3-1)23-8-10-25-24(15-23)17-28(11-12-29-25)16-19-5-9-26-27(13-19)31-18-30-26/h1-5,8-10,13-15H,6-7,11-12,16-18H2