methyl 2-[2-[(2-chlorophenyl)amino]-6-(diethylamino)-9H-xanthen-9-yl]benzoate

Systemtic Name: methyl 2-[2-[(2-chlorophenyl)amino]-6-(diethylamino)-9H-xanthen-9-yl]benzoate Openeye Name: methyl 2-[2-(2-chloroanilino)-6-(diethylamino)-9H-xanthen-9-yl]benzoate CAS Name: 2-[2-(2-chloroanilino)-6-(diethylamino)-9H-xanthen-9-yl]benzoic acid methyl ester IUPAC Name: methyl 2-[2-(2-chloroanilino)-6-(diethylamino)-9H-xanthen-9-yl]benzoate Traditional Name: 2-[2-(2-chloroanilino)-6-(diethylamino)-9H-xanthen-9-yl]benzoic acid methyl ester Formula: C31H29ClN2O3 MolecularWeight: 513.02656

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=CC2=C(C=C1)C(C3=C(O2)C=CC(=C3)NC4=CC=CC=C4Cl)C5=CC=CC=C5C(=O)OC

Isomeric SMILES

CCN(CC)C1=CC2=C(C=C1)C(C3=C(O2)C=CC(=C3)NC4=CC=CC=C4Cl)C5=CC=CC=C5C(=O)OC

InChI

InChI=1S/C31H29ClN2O3/c1-4-34(5-2)21-15-16-24-29(19-21)37-28-17-14-20(33-27-13-9-8-12-26(27)32)18-25(28)30(24)22-10-6-7-11-23(22)31(35)36-3/h6-19,30,33H,4-5H2,1-3H3