methyl 2-[6-(diethylamino)-2-(diphenylamino)-3-ethoxy-9H-xanthen-9-yl]benzoate

Systemtic Name: methyl 2-[6-(diethylamino)-2-(diphenylamino)-3-ethoxy-9H-xanthen-9-yl]benzoate Openeye Name: methyl 2-[6-(diethylamino)-3-ethoxy-2-(N-phenylanilino)-9H-xanthen-9-yl]benzoate CAS Name: 2-[6-(diethylamino)-3-ethoxy-2-(N-phenylanilino)-9H-xanthen-9-yl]benzoic acid methyl ester IUPAC Name: methyl 2-[6-(diethylamino)-3-ethoxy-2-(N-phenylanilino)-9H-xanthen-9-yl]benzoate Traditional Name: 2-[6-(diethylamino)-3-ethoxy-2-(N-phenylanilino)-9H-xanthen-9-yl]benzoic acid methyl ester Formula: C39H38N2O4 MolecularWeight: 598.73002

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=CC2=C(C=C1)C(C3=CC(=C(C=C3O2)OCC)N(C4=CC=CC=C4)C5=CC=CC=C5)C6=CC=CC=C6C(=O)OC

Isomeric SMILES

CCN(CC)C1=CC2=C(C=C1)C(C3=CC(=C(C=C3O2)OCC)N(C4=CC=CC=C4)C5=CC=CC=C5)C6=CC=CC=C6C(=O)OC

InChI

InChI=1S/C39H38N2O4/c1-5-40(6-2)29-22-23-32-35(24-29)45-36-26-37(44-7-3)34(41(27-16-10-8-11-17-27)28-18-12-9-13-19-28)25-33(36)38(32)30-20-14-15-21-31(30)39(42)43-4/h8-26,38H,5-7H2,1-4H3