ethyl 2-[9-chloranyl-3,6-bis(diethylamino)xanthen-9-yl]benzoate

Systemtic Name: ethyl 2-[9-chloranyl-3,6-bis(diethylamino)xanthen-9-yl]benzoate Openeye Name: ethyl 2-[9-chloro-3,6-bis(diethylamino)xanthen-9-yl]benzoate CAS Name: 2-[9-chloro-3,6-bis(diethylamino)-9-xanthenyl]benzoic acid ethyl ester IUPAC Name: ethyl 2-[9-chloro-3,6-bis(diethylamino)xanthen-9-yl]benzoate Traditional Name: 2-[9-chloro-3,6-bis(diethylamino)xanthen-9-yl]benzoic acid ethyl ester Formula: C30H35ClN2O3 MolecularWeight: 507.0635

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=CC2=C(C=C1)C(C3=C(O2)C=C(C=C3)N(CC)CC)(C4=CC=CC=C4C(=O)OCC)Cl

Isomeric SMILES

CCN(CC)C1=CC2=C(C=C1)C(C3=C(O2)C=C(C=C3)N(CC)CC)(C4=CC=CC=C4C(=O)OCC)Cl

InChI

InChI=1S/C30H35ClN2O3/c1-6-32(7-2)21-15-17-25-27(19-21)36-28-20-22(33(8-3)9-4)16-18-26(28)30(25,31)24-14-12-11-13-23(24)29(34)35-10-5/h11-20H,6-10H2,1-5H3