[6-azanyl-9-(2-carboxy-4-methyl-phenyl)xanthen-3-ylidene]azanium

Systemtic Name: [6-azanyl-9-(2-carboxy-4-methyl-phenyl)xanthen-3-ylidene]azanium Openeye Name: [6-amino-9-(2-carboxy-4-methyl-phenyl)xanthen-3-ylidene]ammonium CAS Name: [6-amino-9-(2-carboxy-4-methylphenyl)-3-xanthenylidene]ammonium IUPAC Name: [6-amino-9-(2-carboxy-4-methylphenyl)xanthen-3-ylidene]azanium Traditional Name: [6-amino-9-(2-carboxy-4-methyl-phenyl)xanthen-3-ylidene]ammonium Formula: C21H17N2O3+ MolecularWeight: 345.37128

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C2=C3C=CC(=[NH2+])C=C3OC4=C2C=CC(=C4)N)C(=O)O

Isomeric SMILES

CC1=CC(=C(C=C1)C2=C3C=CC(=[NH2+])C=C3OC4=C2C=CC(=C4)N)C(=O)O

InChI

InChI=1S/C21H16N2O3/c1-11-2-5-14(17(8-11)21(24)25)20-15-6-3-12(22)9-18(15)26-19-10-13(23)4-7-16(19)20/h2-10,22H,23H2,1H3,(H,24,25)/p+1