(Z)-but-2-enedioic acid; 10-[7-(4-methylpiperazin-1-yl)heptyl]phenothiazine

Systemtic Name: (Z)-but-2-enedioic acid; 10-[7-(4-methylpiperazin-1-yl)heptyl]phenothiazine Openeye Name: maleic acid; 10-[7-(4-methylpiperazin-1-yl)heptyl]phenothiazine CAS Name: (Z)-2-butenedioic acid; 10-[7-(4-methyl-1-piperazinyl)heptyl]phenothiazine IUPAC Name: (Z)-but-2-enedioic acid; 10-[7-(4-methylpiperazin-1-yl)heptyl]phenothiazine Traditional Name: maleic acid; 10-[7-(4-methylpiperazino)heptyl]phenothiazine Formula: C32H41N3O8S MolecularWeight: 627.74824

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)CCCCCCCN2C3=CC=CC=C3SC4=CC=CC=C42.C(=CC(=O)O)C(=O)O.C(=CC(=O)O)C(=O)O

Isomeric SMILES

CN1CCN(CC1)CCCCCCCN2C3=CC=CC=C3SC4=CC=CC=C24.C(=C\C(=O)O)\C(=O)O.C(=C\C(=O)O)\C(=O)O

InChI

InChI=1S/C24H33N3S.2C4H4O4/c1-25-17-19-26(20-18-25)15-9-3-2-4-10-16-27-21-11-5-7-13-23(21)28-24-14-8-6-12-22(24)27;2*5-3(6)1-2-4(7)8/h5-8,11-14H,2-4,9-10,15-20H2,1H3;2*1-2H,(H,5,6)(H,7,8)/b;2*2-1-