[2-[(5-chloranyl-2-methyl-phenyl)amino]-2-oxidanylidene-ethyl]-ethyl-[(7-oxidanyl-2-oxidanylidene-chromen-4-yl)methyl]azanium

Systemtic Name: [2-[(5-chloranyl-2-methyl-phenyl)amino]-2-oxidanylidene-ethyl]-ethyl-[(7-oxidanyl-2-oxidanylidene-chromen-4-yl)methyl]azanium Openeye Name: [2-(5-chloro-2-methyl-anilino)-2-oxo-ethyl]-ethyl-[(7-hydroxy-2-oxo-chromen-4-yl)methyl]ammonium CAS Name: [2-(5-chloro-2-methylanilino)-2-oxoethyl]-ethyl-[(7-hydroxy-2-oxo-1-benzopyran-4-yl)methyl]ammonium IUPAC Name: [2-(5-chloro-2-methylanilino)-2-oxoethyl]-ethyl-[(7-hydroxy-2-oxochromen-4-yl)methyl]azanium Traditional Name: [2-(5-chloro-2-methyl-anilino)-2-keto-ethyl]-ethyl-[(7-hydroxy-2-keto-chromen-4-yl)methyl]ammonium Formula: C21H22ClN2O4+ MolecularWeight: 401.86338

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC1=CC(=O)OC2=C1C=CC(=C2)O)CC(=O)NC3=C(C=CC(=C3)Cl)C

Isomeric SMILES

CC[NH+](CC1=CC(=O)OC2=C1C=CC(=C2)O)CC(=O)NC3=C(C=CC(=C3)Cl)C

InChI

InChI=1S/C21H21ClN2O4/c1-3-24(12-20(26)23-18-9-15(22)5-4-13(18)2)11-14-8-21(27)28-19-10-16(25)6-7-17(14)19/h4-10,25H,3,11-12H2,1-2H3,(H,23,26)/p+1