1,3-benzodioxol-5-yl-[4-(8-methoxybenzo[b][1,4]benzoxazepin-6-yl)-2-methyl-piperazin-1-yl]methanone

Systemtic Name: 1,3-benzodioxol-5-yl-[4-(8-methoxybenzo[b][1,4]benzoxazepin-6-yl)-2-methyl-piperazin-1-yl]methanone Openeye Name: 1,3-benzodioxol-5-yl-[4-(8-methoxybenzo[b][1,4]benzoxazepin-6-yl)-2-methyl-piperazin-1-yl]methanone CAS Name: 1,3-benzodioxol-5-yl-[4-(8-methoxy-6-benzo[b][1,4]benzoxazepinyl)-2-methyl-1-piperazinyl]methanone IUPAC Name: 1,3-benzodioxol-5-yl-[4-(8-methoxybenzo[b][1,4]benzoxazepin-6-yl)-2-methylpiperazin-1-yl]methanone Traditional Name: 1,3-benzodioxol-5-yl-[4-(8-methoxybenzo[b][1,4]benzoxazepin-6-yl)-2-methyl-piperazino]methanone Formula: C27H25N3O5 MolecularWeight: 471.5045

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1C(=O)C2=CC3=C(C=C2)OCO3)C4=NC5=CC=CC=C5OC6=C4C=C(C=C6)OC

Isomeric SMILES

CC1CN(CCN1C(=O)C2=CC3=C(C=C2)OCO3)C4=NC5=CC=CC=C5OC6=C4C=C(C=C6)OC

InChI

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