(Z)-but-2-enedioic acid; 3-methyl-10-[4-(4-methylpiperazin-1-yl)butyl]phenothiazine

Systemtic Name: (Z)-but-2-enedioic acid; 3-methyl-10-[4-(4-methylpiperazin-1-yl)butyl]phenothiazine Openeye Name: maleic acid; 3-methyl-10-[4-(4-methylpiperazin-1-yl)butyl]phenothiazine CAS Name: (Z)-2-butenedioic acid; 3-methyl-10-[4-(4-methyl-1-piperazinyl)butyl]phenothiazine IUPAC Name: (Z)-but-2-enedioic acid; 3-methyl-10-[4-(4-methylpiperazin-1-yl)butyl]phenothiazine Traditional Name: maleic acid; 3-methyl-10-[4-(4-methylpiperazino)butyl]phenothiazine Formula: C30H37N3O8S MolecularWeight: 599.69508

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N(C3=CC=CC=C3S2)CCCCN4CCN(CC4)C.C(=CC(=O)O)C(=O)O.C(=CC(=O)O)C(=O)O

Isomeric SMILES

CC1=CC2=C(N(C3=CC=CC=C3S2)CCCCN4CCN(CC4)C)C=C1.C(=C\C(=O)O)\C(=O)O.C(=C\C(=O)O)\C(=O)O

InChI

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