methyl 3-[(10-methylphenazin-10-ium-2-yl)amino]propanoate perchlorate

Systemtic Name: methyl 3-[(10-methylphenazin-10-ium-2-yl)amino]propanoate perchlorate Openeye Name: methyl 3-[(10-methylphenazin-10-ium-2-yl)amino]propanoate perchlorate CAS Name: 3-[(10-methyl-2-phenazin-10-iumyl)amino]propanoic acid methyl ester perchlorate IUPAC Name: methyl 3-[(10-methylphenazin-10-ium-2-yl)amino]propanoate perchlorate Traditional Name: 3-[(10-methylphenazin-10-ium-2-yl)amino]propionic acid methyl ester perchlorate Formula: C17H18ClN3O6 MolecularWeight: 395.79432

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=C2C=C(C=CC2=NC3=CC=CC=C31)NCCC(=O)OC.[O-]Cl(=O)(=O)=O

Isomeric SMILES

C[N+]1=C2C=C(C=CC2=NC3=CC=CC=C31)NCCC(=O)OC.[O-]Cl(=O)(=O)=O

InChI

InChI=1S/C17H17N3O2.ClHO4/c1-20-15-6-4-3-5-13(15)19-14-8-7-12(11-16(14)20)18-10-9-17(21)22-2;2-1(3,4)5/h3-8,11H,9-10H2,1-2H3;(H,2,3,4,5)