(Z)-but-2-enedioic acid; 1-phenothiazin-10-yl-3-(2-piperidin-1-ylethylamino)propan-1-one

Systemtic Name: (Z)-but-2-enedioic acid; 1-phenothiazin-10-yl-3-(2-piperidin-1-ylethylamino)propan-1-one Openeye Name: maleic acid; 1-phenothiazin-10-yl-3-[2-(1-piperidyl)ethylamino]propan-1-one CAS Name: (Z)-2-butenedioic acid; 1-(10-phenothiazinyl)-3-[2-(1-piperidinyl)ethylamino]-1-propanone IUPAC Name: (Z)-but-2-enedioic acid; 1-phenothiazin-10-yl-3-(2-piperidin-1-ylethylamino)propan-1-one Traditional Name: maleic acid; 1-phenothiazin-10-yl-3-(2-piperidinoethylamino)propan-1-one Formula: C30H35N3O9S MolecularWeight: 613.6786

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CCNCCC(=O)N2C3=CC=CC=C3SC4=CC=CC=C42.C(=CC(=O)O)C(=O)O.C(=CC(=O)O)C(=O)O

Isomeric SMILES

C1CCN(CC1)CCNCCC(=O)N2C3=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/C22H27N3OS.2C4H4O4/c26-22(12-13-23-14-17-24-15-6-1-7-16-24)25-18-8-2-4-10-20(18)27-21-11-5-3-9-19(21)25;2*5-3(6)1-2-4(7)8/h2-5,8-11,23H,1,6-7,12-17H2;2*1-2H,(H,5,6)(H,7,8)/b;2*2-1-