[5-[(2-chlorophenyl)amino]-2-(diethylamino)xanthen-3-ylidene]-diethyl-azanium

Systemtic Name: [5-[(2-chlorophenyl)amino]-2-(diethylamino)xanthen-3-ylidene]-diethyl-azanium Openeye Name: [5-(2-chloroanilino)-2-(diethylamino)xanthen-3-ylidene]-diethyl-ammonium CAS Name: [5-(2-chloroanilino)-2-(diethylamino)-3-xanthenylidene]-diethylammonium IUPAC Name: [5-(2-chloroanilino)-2-(diethylamino)xanthen-3-ylidene]-diethylazanium Traditional Name: [5-(2-chloroanilino)-2-(diethylamino)xanthen-3-ylidene]-diethyl-ammonium Formula: C27H31ClN3O+ MolecularWeight: 449.00754

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=CC2=CC3=C(C(=CC=C3)NC4=CC=CC=C4Cl)OC2=CC1=[N+](CC)CC

Isomeric SMILES

CCN(CC)C1=CC2=CC3=C(C(=CC=C3)NC4=CC=CC=C4Cl)OC2=CC1=[N+](CC)CC

InChI

InChI=1S/C27H31ClN3O/c1-5-30(6-2)24-17-20-16-19-12-11-15-23(29-22-14-10-9-13-21(22)28)27(19)32-26(20)18-25(24)31(7-3)8-4/h9-18,29H,5-8H2,1-4H3/q+1