8-[[(3-chlorophenyl)methylazaniumyl]methyl]-3-(2-methoxy-2-oxidanylidene-ethyl)-4-methyl-2-oxidanylidene-chromen-7-olate

Systemtic Name: 8-[[(3-chlorophenyl)methylazaniumyl]methyl]-3-(2-methoxy-2-oxidanylidene-ethyl)-4-methyl-2-oxidanylidene-chromen-7-olate Openeye Name: 8-[[(3-chlorophenyl)methylammonio]methyl]-3-(2-methoxy-2-oxo-ethyl)-4-methyl-2-oxo-chromen-7-olate CAS Name: 8-[[(3-chlorophenyl)methylammonio]methyl]-3-(2-methoxy-2-oxoethyl)-4-methyl-2-oxo-1-benzopyran-7-olate IUPAC Name: 8-[[(3-chlorophenyl)methylazaniumyl]methyl]-3-(2-methoxy-2-oxoethyl)-4-methyl-2-oxochromen-7-olate Traditional Name: 8-[[(3-chlorobenzyl)ammonio]methyl]-2-keto-3-(2-keto-2-methoxy-ethyl)-4-methyl-chromen-7-olate Formula: C21H20ClNO5 MolecularWeight: 401.8402

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)OC2=C1C=CC(=C2C[NH2+]CC3=CC(=CC=C3)Cl)[O-])CC(=O)OC

Isomeric SMILES

CC1=C(C(=O)OC2=C1C=CC(=C2C[NH2+]CC3=CC(=CC=C3)Cl)[O-])CC(=O)OC

InChI

InChI=1S/C21H20ClNO5/c1-12-15-6-7-18(24)17(11-23-10-13-4-3-5-14(22)8-13)20(15)28-21(26)16(12)9-19(25)27-2/h3-8,23-24H,9-11H2,1-2H3