2,3-bis(oxidanyl)butanedioate; N,N,2-trimethyl-3-phenothiazin-10-yl-propan-1-amine

Systemtic Name: 2,3-bis(oxidanyl)butanedioate; N,N,2-trimethyl-3-phenothiazin-10-yl-propan-1-amine Openeye Name: 2,3-dihydroxybutanedioate; N,N,2-trimethyl-3-phenothiazin-10-yl-propan-1-amine CAS Name: 2,3-dihydroxybutanedioate; N,N,2-trimethyl-3-(10-phenothiazinyl)-1-propanamine IUPAC Name: 2,3-dihydroxybutanedioate; N,N,2-trimethyl-3-phenothiazin-10-ylpropan-1-amine Traditional Name: dimethyl-(2-methyl-3-phenothiazin-10-yl-propyl)amine tartrate Formula: C40H48N4O6S2-2 MolecularWeight: 744.96232

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Descriptors Computed from Structure

Canonical SMILES:

CC(CN1C2=CC=CC=C2SC3=CC=CC=C31)CN(C)C.CC(CN1C2=CC=CC=C2SC3=CC=CC=C31)CN(C)C.C(C(C(=O)[O-])O)(C(=O)[O-])O

Isomeric SMILES

CC(CN1C2=CC=CC=C2SC3=CC=CC=C31)CN(C)C.CC(CN1C2=CC=CC=C2SC3=CC=CC=C31)CN(C)C.C(C(C(=O)[O-])O)(C(=O)[O-])O

InChI

InChI=1S/2C18H22N2S.C4H6O6/c2*1-14(12-19(2)3)13-20-15-8-4-6-10-17(15)21-18-11-7-5-9-16(18)20;5-1(3(7)8)2(6)4(9)10/h2*4-11,14H,12-13H2,1-3H3;1-2,5-6H,(H,7,8)(H,9,10)/p-2