2-[3-(ethylideneamino)-2,7-dimethyl-6-methylimino-xanthen-9-yl]benzoic acid

Systemtic Name: 2-[3-(ethylideneamino)-2,7-dimethyl-6-methylimino-xanthen-9-yl]benzoic acid Openeye Name: 2-[3-(ethylideneamino)-2,7-dimethyl-6-methylimino-xanthen-9-yl]benzoic acid CAS Name: 2-[3-(ethylideneamino)-2,7-dimethyl-6-methylimino-9-xanthenyl]benzoic acid IUPAC Name: 2-[3-(ethylideneamino)-2,7-dimethyl-6-methyliminoxanthen-9-yl]benzoic acid Traditional Name: 2-[3-(ethylideneamino)-2,7-dimethyl-6-methylimino-xanthen-9-yl]benzoic acid Formula: C25H22N2O3 MolecularWeight: 398.45378

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Descriptors Computed from Structure

Canonical SMILES:

CC=NC1=C(C=C2C(=C1)OC3=CC(=NC)C(=CC3=C2C4=CC=CC=C4C(=O)O)C)C

Isomeric SMILES

CC=NC1=C(C=C2C(=C1)OC3=CC(=NC)C(=CC3=C2C4=CC=CC=C4C(=O)O)C)C

InChI

InChI=1S/C25H22N2O3/c1-5-27-21-13-23-19(11-15(21)3)24(16-8-6-7-9-17(16)25(28)29)18-10-14(2)20(26-4)12-22(18)30-23/h5-13H,1-4H3,(H,28,29)