2-[4-(ethylamino)-6-ethylimino-3,7-dimethyl-xanthen-1-yl]benzoic acid

Systemtic Name: 2-[4-(ethylamino)-6-ethylimino-3,7-dimethyl-xanthen-1-yl]benzoic acid Openeye Name: 2-[4-(ethylamino)-6-ethylimino-3,7-dimethyl-xanthen-1-yl]benzoic acid CAS Name: 2-[4-(ethylamino)-6-ethylimino-3,7-dimethyl-1-xanthenyl]benzoic acid IUPAC Name: 2-[4-(ethylamino)-6-ethylimino-3,7-dimethylxanthen-1-yl]benzoic acid Traditional Name: 2-[4-(ethylamino)-6-ethylimino-3,7-dimethyl-xanthen-1-yl]benzoic acid Formula: C26H26N2O3 MolecularWeight: 414.49624

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Descriptors Computed from Structure

Canonical SMILES:

CCNC1=C(C=C(C2=C1OC3=CC(=NCC)C(=CC3=C2)C)C4=CC=CC=C4C(=O)O)C

Isomeric SMILES

CCNC1=C(C=C(C2=C1OC3=CC(=NCC)C(=CC3=C2)C)C4=CC=CC=C4C(=O)O)C

InChI

InChI=1S/C26H26N2O3/c1-5-27-22-14-23-17(11-15(22)3)13-21-20(18-9-7-8-10-19(18)26(29)30)12-16(4)24(28-6-2)25(21)31-23/h7-14,28H,5-6H2,1-4H3,(H,29,30)