6-[(4-methylpiperazin-1-yl)methyl]-13H-benzo[e][3,1,7]benzoxadiazecine-8,14-dione

Systemtic Name: 6-[(4-methylpiperazin-1-yl)methyl]-13H-benzo[e][3,1,7]benzoxadiazecine-8,14-dione Openeye Name: 6-[(4-methylpiperazin-1-yl)methyl]-13H-benzo[e][3,1,7]benzoxadiazecine-8,14-dione CAS Name: 6-[(4-methyl-1-piperazinyl)methyl]-13H-benzo[e][3,1,7]benzoxadiazecine-8,14-dione IUPAC Name: 6-[(4-methylpiperazin-1-yl)methyl]-13H-benzo[e][3,1,7]benzoxadiazecine-8,14-dione Traditional Name: 6-[(4-methylpiperazino)methyl]-13H-benzo[e][3,1,7]benzoxadiazecine-8,14-quinone Formula: C21H22N4O3 MolecularWeight: 378.42438

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)CC2=NC3=CC=CC=C3C(=O)NC4=CC=CC=C4C(=O)O2

Isomeric SMILES

CN1CCN(CC1)CC2=NC3=CC=CC=C3C(=O)NC4=CC=CC=C4C(=O)O2

InChI

InChI=1S/C21H22N4O3/c1-24-10-12-25(13-11-24)14-19-22-17-8-4-2-6-15(17)20(26)23-18-9-5-3-7-16(18)21(27)28-19/h2-9H,10-14H2,1H3,(H,23,26)