methyl 2-[2-[bis(4-methylphenyl)amino]-6-(diethylamino)-3-phenoxy-9H-xanthen-9-yl]benzoate

Systemtic Name: methyl 2-[2-[bis(4-methylphenyl)amino]-6-(diethylamino)-3-phenoxy-9H-xanthen-9-yl]benzoate Openeye Name: methyl 2-[6-(diethylamino)-2-[4-methyl-N-(p-tolyl)anilino]-3-phenoxy-9H-xanthen-9-yl]benzoate CAS Name: 2-[6-(diethylamino)-2-(4-methyl-N-(4-methylphenyl)anilino)-3-phenoxy-9H-xanthen-9-yl]benzoic acid methyl ester IUPAC Name: methyl 2-[6-(diethylamino)-2-(4-methyl-N-(4-methylphenyl)anilino)-3-phenoxy-9H-xanthen-9-yl]benzoate Traditional Name: 2-[6-(diethylamino)-2-[4-methyl-N-(p-tolyl)anilino]-3-phenoxy-9H-xanthen-9-yl]benzoic acid methyl ester Formula: C45H42N2O4 MolecularWeight: 674.82598

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=CC2=C(C=C1)C(C3=CC(=C(C=C3O2)OC4=CC=CC=C4)N(C5=CC=C(C=C5)C)C6=CC=C(C=C6)C)C7=CC=CC=C7C(=O)OC

Isomeric SMILES

CCN(CC)C1=CC2=C(C=C1)C(C3=CC(=C(C=C3O2)OC4=CC=CC=C4)N(C5=CC=C(C=C5)C)C6=CC=C(C=C6)C)C7=CC=CC=C7C(=O)OC

InChI

InChI=1S/C45H42N2O4/c1-6-46(7-2)34-25-26-38-41(27-34)51-42-29-43(50-35-13-9-8-10-14-35)40(28-39(42)44(38)36-15-11-12-16-37(36)45(48)49-5)47(32-21-17-30(3)18-22-32)33-23-19-31(4)20-24-33/h8-29,44H,6-7H2,1-5H3