(Z)-but-2-enedioic acid; 2-[3-(diethylamino)propylamino]-1-phenothiazin-10-yl-ethanone

Systemtic Name: (Z)-but-2-enedioic acid; 2-[3-(diethylamino)propylamino]-1-phenothiazin-10-yl-ethanone Openeye Name: 2-[3-(diethylamino)propylamino]-1-phenothiazin-10-yl-ethanone; maleic acid CAS Name: (Z)-2-butenedioic acid; 2-[3-(diethylamino)propylamino]-1-(10-phenothiazinyl)ethanone IUPAC Name: (Z)-but-2-enedioic acid; 2-[3-(diethylamino)propylamino]-1-phenothiazin-10-ylethanone Traditional Name: 2-[3-(diethylamino)propylamino]-1-phenothiazin-10-yl-ethanone; maleic acid Formula: C29H35N3O9S MolecularWeight: 601.6679

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCCNCC(=O)N1C2=CC=CC=C2SC3=CC=CC=C31.C(=CC(=O)O)C(=O)O.C(=CC(=O)O)C(=O)O

Isomeric SMILES

CCN(CCCNCC(=O)N1C2=CC=CC=C2SC3=CC=CC=C13)CC.C(=C\C(=O)O)\C(=O)O.C(=C\C(=O)O)\C(=O)O

InChI

InChI=1S/C21H27N3OS.2C4H4O4/c1-3-23(4-2)15-9-14-22-16-21(25)24-17-10-5-7-12-19(17)26-20-13-8-6-11-18(20)24;2*5-3(6)1-2-4(7)8/h5-8,10-13,22H,3-4,9,14-16H2,1-2H3;2*1-2H,(H,5,6)(H,7,8)/b;2*2-1-