3-(4-chlorophenyl)-4-methyl-8-(morpholin-4-ium-4-ylmethyl)-2-oxidanylidene-chromen-7-olate

Systemtic Name: 3-(4-chlorophenyl)-4-methyl-8-(morpholin-4-ium-4-ylmethyl)-2-oxidanylidene-chromen-7-olate Openeye Name: 3-(4-chlorophenyl)-4-methyl-8-(morpholin-4-ium-4-ylmethyl)-2-oxo-chromen-7-olate CAS Name: 3-(4-chlorophenyl)-4-methyl-8-(4-morpholin-4-iumylmethyl)-2-oxo-1-benzopyran-7-olate IUPAC Name: 3-(4-chlorophenyl)-4-methyl-8-(morpholin-4-ium-4-ylmethyl)-2-oxochromen-7-olate Traditional Name: 3-(4-chlorophenyl)-2-keto-4-methyl-8-(morpholin-4-ium-4-ylmethyl)chromen-7-olate Formula: C21H20ClNO4 MolecularWeight: 385.8408

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)OC2=C1C=CC(=C2C[NH+]3CCOCC3)[O-])C4=CC=C(C=C4)Cl

Isomeric SMILES

CC1=C(C(=O)OC2=C1C=CC(=C2C[NH+]3CCOCC3)[O-])C4=CC=C(C=C4)Cl

InChI

InChI=1S/C21H20ClNO4/c1-13-16-6-7-18(24)17(12-23-8-10-26-11-9-23)20(16)27-21(25)19(13)14-2-4-15(22)5-3-14/h2-7,24H,8-12H2,1H3