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

Systemtic Name: methyl 2-[2-[bis(phenylmethyl)amino]-6-(diethylamino)-9H-xanthen-9-yl]benzoate Openeye Name: methyl 2-[2-(dibenzylamino)-6-(diethylamino)-9H-xanthen-9-yl]benzoate CAS Name: 2-[2-[bis(phenylmethyl)amino]-6-(diethylamino)-9H-xanthen-9-yl]benzoic acid methyl ester IUPAC Name: methyl 2-[2-(dibenzylamino)-6-(diethylamino)-9H-xanthen-9-yl]benzoate Traditional Name: 2-[2-(dibenzylamino)-6-(diethylamino)-9H-xanthen-9-yl]benzoic acid methyl ester Formula: C39H38N2O3 MolecularWeight: 582.73062

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=CC2=C(C=C1)C(C3=C(O2)C=CC(=C3)N(CC4=CC=CC=C4)CC5=CC=CC=C5)C6=CC=CC=C6C(=O)OC

Isomeric SMILES

CCN(CC)C1=CC2=C(C=C1)C(C3=C(O2)C=CC(=C3)N(CC4=CC=CC=C4)CC5=CC=CC=C5)C6=CC=CC=C6C(=O)OC

InChI

InChI=1S/C39H38N2O3/c1-4-40(5-2)31-20-22-34-37(25-31)44-36-23-21-30(24-35(36)38(34)32-18-12-13-19-33(32)39(42)43-3)41(26-28-14-8-6-9-15-28)27-29-16-10-7-11-17-29/h6-25,38H,4-5,26-27H2,1-3H3