3-(2-chloranylphenothiazin-10-yl)-N,N-dimethyl-propan-1-amine; 2-oxidanylbutanedioic acid

Systemtic Name: 3-(2-chloranylphenothiazin-10-yl)-N,N-dimethyl-propan-1-amine; 2-oxidanylbutanedioic acid Openeye Name: 3-(2-chlorophenothiazin-10-yl)-N,N-dimethyl-propan-1-amine; 2-hydroxybutanedioic acid CAS Name: 3-(2-chloro-10-phenothiazinyl)-N,N-dimethyl-1-propanamine; 2-hydroxybutanedioic acid IUPAC Name: 3-(2-chlorophenothiazin-10-yl)-N,N-dimethylpropan-1-amine; 2-hydroxybutanedioic acid Traditional Name: 3-(2-chlorophenothiazin-10-yl)propyl-dimethyl-amine; malic acid Formula: C21H25ClN2O5S MolecularWeight: 452.9516

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCCN1C2=CC=CC=C2SC3=C1C=C(C=C3)Cl.C(C(C(=O)O)O)C(=O)O

Isomeric SMILES

CN(C)CCCN1C2=CC=CC=C2SC3=C1C=C(C=C3)Cl.C(C(C(=O)O)O)C(=O)O

InChI

InChI=1S/C17H19ClN2S.C4H6O5/c1-19(2)10-5-11-20-14-6-3-4-7-16(14)21-17-9-8-13(18)12-15(17)20;5-2(4(8)9)1-3(6)7/h3-4,6-9,12H,5,10-11H2,1-2H3;2,5H,1H2,(H,6,7)(H,8,9)