(Z)-but-2-enedioic acid; 10-[5-(4-methylpiperazin-1-yl)pentyl]phenothiazine

Systemtic Name: (Z)-but-2-enedioic acid; 10-[5-(4-methylpiperazin-1-yl)pentyl]phenothiazine Openeye Name: maleic acid; 10-[5-(4-methylpiperazin-1-yl)pentyl]phenothiazine CAS Name: (Z)-2-butenedioic acid; 10-[5-(4-methyl-1-piperazinyl)pentyl]phenothiazine IUPAC Name: (Z)-but-2-enedioic acid; 10-[5-(4-methylpiperazin-1-yl)pentyl]phenothiazine Traditional Name: maleic acid; 10-[5-(4-methylpiperazino)pentyl]phenothiazine Formula: C30H37N3O8S MolecularWeight: 599.69508

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)CCCCCN2C3=CC=CC=C3SC4=CC=CC=C42.C(=CC(=O)O)C(=O)O.C(=CC(=O)O)C(=O)O

Isomeric SMILES

CN1CCN(CC1)CCCCCN2C3=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/C22H29N3S.2C4H4O4/c1-23-15-17-24(18-16-23)13-7-2-8-14-25-19-9-3-5-11-21(19)26-22-12-6-4-10-20(22)25;2*5-3(6)1-2-4(7)8/h3-6,9-12H,2,7-8,13-18H2,1H3;2*1-2H,(H,5,6)(H,7,8)/b;2*2-1-