4-[3-(methylamino)-6-methylimino-xanthen-9-yl]benzene-1,3-dicarboxylic acid

Systemtic Name: 4-[3-(methylamino)-6-methylimino-xanthen-9-yl]benzene-1,3-dicarboxylic acid Openeye Name: 4-[3-(methylamino)-6-methylimino-xanthen-9-yl]benzene-1,3-dicarboxylic acid CAS Name: 4-[3-(methylamino)-6-methylimino-9-xanthenyl]benzene-1,3-dicarboxylic acid IUPAC Name: 4-[3-(methylamino)-6-methyliminoxanthen-9-yl]benzene-1,3-dicarboxylic acid Traditional Name: 4-[3-(methylamino)-6-methylimino-xanthen-9-yl]isophthalic acid Formula: C23H18N2O5 MolecularWeight: 402.39942

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=CC2=C(C=C1)C(=C3C=CC(=NC)C=C3O2)C4=C(C=C(C=C4)C(=O)O)C(=O)O

Isomeric SMILES

CNC1=CC2=C(C=C1)C(=C3C=CC(=NC)C=C3O2)C4=C(C=C(C=C4)C(=O)O)C(=O)O

InChI

InChI=1S/C23H18N2O5/c1-24-13-4-7-16-19(10-13)30-20-11-14(25-2)5-8-17(20)21(16)15-6-3-12(22(26)27)9-18(15)23(28)29/h3-11,24H,1-2H3,(H,26,27)(H,28,29)