2-[6-(dimethylamino)-5-methyl-9-oxidanylidene-xanthen-4-yl]ethanoic acid

Systemtic Name: 2-[6-(dimethylamino)-5-methyl-9-oxidanylidene-xanthen-4-yl]ethanoic acid Openeye Name: 2-[6-(dimethylamino)-5-methyl-9-oxo-xanthen-4-yl]acetic acid CAS Name: 2-[6-(dimethylamino)-5-methyl-9-oxo-4-xanthenyl]acetic acid IUPAC Name: 2-[6-(dimethylamino)-5-methyl-9-oxoxanthen-4-yl]acetic acid Traditional Name: 2-[6-(dimethylamino)-9-keto-5-methyl-xanthen-4-yl]acetic acid Formula: C18H17NO4 MolecularWeight: 311.33188

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC2=C1OC3=C(C2=O)C=CC=C3CC(=O)O)N(C)C

Isomeric SMILES

CC1=C(C=CC2=C1OC3=C(C2=O)C=CC=C3CC(=O)O)N(C)C

InChI

InChI=1S/C18H17NO4/c1-10-14(19(2)3)8-7-13-16(22)12-6-4-5-11(9-15(20)21)18(12)23-17(10)13/h4-8H,9H2,1-3H3,(H,20,21)