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

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

Systemtic Name:3-(2-chloranylphenothiazin-10-yl)-N,N-dimethyl-propan-1-amine; hexadecanoic acid
Openeye Name:3-(2-chlorophenothiazin-10-yl)-N,N-dimethyl-propan-1-amine; palmitic acid
CAS Name:3-(2-chloro-10-phenothiazinyl)-N,N-dimethyl-1-propanamine; hexadecanoic acid
IUPAC Name:3-(2-chlorophenothiazin-10-yl)-N,N-dimethylpropan-1-amine; hexadecanoic acid
Traditional Name:3-(2-chlorophenothiazin-10-yl)propyl-dimethyl-amine; palmitic acid
Formula: C33H51ClN2O2S
MolecularWeight: 575.28824
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Descriptors Computed from Structure

Canonical SMILES:

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


Isomeric SMILES

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


InChI

InChI=1S/C17H19ClN2S.C16H32O2/c1-19(2)10-5-11-20-14-6-3-4-7-16(14)21-17-9-8-13(18)12-15(17)20;1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16(17)18/h3-4,6-9,12H,5,10-11H2,1-2H3;2-15H2,1H3,(H,17,18)


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