methyl 2-[3,6-bis(diphenylamino)-9H-xanthen-9-yl]benzoate

Systemtic Name: methyl 2-[3,6-bis(diphenylamino)-9H-xanthen-9-yl]benzoate Openeye Name: methyl 2-[3,6-bis(N-phenylanilino)-9H-xanthen-9-yl]benzoate CAS Name: 2-[3,6-bis(N-phenylanilino)-9H-xanthen-9-yl]benzoic acid methyl ester IUPAC Name: methyl 2-[3,6-bis(N-phenylanilino)-9H-xanthen-9-yl]benzoate Traditional Name: 2-[3,6-bis(N-phenylanilino)-9H-xanthen-9-yl]benzoic acid methyl ester Formula: C45H34N2O3 MolecularWeight: 650.76306

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC=C1C2C3=C(C=C(C=C3)N(C4=CC=CC=C4)C5=CC=CC=C5)OC6=C2C=CC(=C6)N(C7=CC=CC=C7)C8=CC=CC=C8

Isomeric SMILES

COC(=O)C1=CC=CC=C1C2C3=C(C=C(C=C3)N(C4=CC=CC=C4)C5=CC=CC=C5)OC6=C2C=CC(=C6)N(C7=CC=CC=C7)C8=CC=CC=C8

InChI

InChI=1S/C45H34N2O3/c1-49-45(48)39-25-15-14-24-38(39)44-40-28-26-36(46(32-16-6-2-7-17-32)33-18-8-3-9-19-33)30-42(40)50-43-31-37(27-29-41(43)44)47(34-20-10-4-11-21-34)35-22-12-5-13-23-35/h2-31,44H,1H3