carboxymethylcarbamoyl-dimethyl-(10-nitrophenothiazin-3-yl)azanium

Systemtic Name: carboxymethylcarbamoyl-dimethyl-(10-nitrophenothiazin-3-yl)azanium Openeye Name: carboxymethylcarbamoyl-dimethyl-(10-nitrophenothiazin-3-yl)ammonium CAS Name: [(carboxymethylamino)-oxomethyl]-dimethyl-(10-nitro-3-phenothiazinyl)ammonium IUPAC Name: carboxymethylcarbamoyl-dimethyl-(10-nitrophenothiazin-3-yl)azanium Traditional Name: carboxymethylcarbamoyl-dimethyl-(10-nitrophenothiazin-3-yl)ammonium Formula: C17H17N4O5S+ MolecularWeight: 389.40568

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(C1=CC2=C(C=C1)N(C3=CC=CC=C3S2)[N+](=O)[O-])C(=O)NCC(=O)O

Isomeric SMILES

C[N+](C)(C1=CC2=C(C=C1)N(C3=CC=CC=C3S2)[N+](=O)[O-])C(=O)NCC(=O)O

InChI

InChI=1S/C17H16N4O5S/c1-21(2,17(24)18-10-16(22)23)11-7-8-13-15(9-11)27-14-6-4-3-5-12(14)19(13)20(25)26/h3-9H,10H2,1-2H3,(H-,18,22,23,24)/p+1