1,3-benzodioxol-5-yl-[4-(10-methoxybenzo[b][1,4]benzoxazepin-6-yl)-2-methyl-piperazin-1-yl]methanone

Systemtic Name: 1,3-benzodioxol-5-yl-[4-(10-methoxybenzo[b][1,4]benzoxazepin-6-yl)-2-methyl-piperazin-1-yl]methanone Openeye Name: 1,3-benzodioxol-5-yl-[4-(10-methoxybenzo[b][1,4]benzoxazepin-6-yl)-2-methyl-piperazin-1-yl]methanone CAS Name: 1,3-benzodioxol-5-yl-[4-(10-methoxy-6-benzo[b][1,4]benzoxazepinyl)-2-methyl-1-piperazinyl]methanone IUPAC Name: 1,3-benzodioxol-5-yl-[4-(10-methoxybenzo[b][1,4]benzoxazepin-6-yl)-2-methylpiperazin-1-yl]methanone Traditional Name: 1,3-benzodioxol-5-yl-[4-(10-methoxybenzo[b][1,4]benzoxazepin-6-yl)-2-methyl-piperazino]methanone Formula: C27H25N3O5 MolecularWeight: 471.5045

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1C(=O)C2=CC3=C(C=C2)OCO3)C4=NC5=CC=CC=C5OC6=C4C=CC=C6OC

Isomeric SMILES

CC1CN(CCN1C(=O)C2=CC3=C(C=C2)OCO3)C4=NC5=CC=CC=C5OC6=C4C=CC=C6OC

InChI

InChI=1S/C27H25N3O5/c1-17-15-29(12-13-30(17)27(31)18-10-11-22-24(14-18)34-16-33-22)26-19-6-5-9-23(32-2)25(19)35-21-8-4-3-7-20(21)28-26/h3-11,14,17H,12-13,15-16H2,1-2H3