(6-chloranyl-7-methyl-2-oxidanylidene-chromen-4-yl)methyl-[2-(3,4-diethoxyphenyl)ethyl]azanium

Systemtic Name: (6-chloranyl-7-methyl-2-oxidanylidene-chromen-4-yl)methyl-[2-(3,4-diethoxyphenyl)ethyl]azanium Openeye Name: (6-chloro-7-methyl-2-oxo-chromen-4-yl)methyl-[2-(3,4-diethoxyphenyl)ethyl]ammonium CAS Name: (6-chloro-7-methyl-2-oxo-1-benzopyran-4-yl)methyl-[2-(3,4-diethoxyphenyl)ethyl]ammonium IUPAC Name: (6-chloro-7-methyl-2-oxochromen-4-yl)methyl-[2-(3,4-diethoxyphenyl)ethyl]azanium Traditional Name: (6-chloro-2-keto-7-methyl-chromen-4-yl)methyl-[2-(3,4-diethoxyphenyl)ethyl]ammonium Formula: C23H27ClNO4+ MolecularWeight: 416.91778

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)CC[NH2+]CC2=CC(=O)OC3=CC(=C(C=C23)Cl)C)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)CC[NH2+]CC2=CC(=O)OC3=CC(=C(C=C23)Cl)C)OCC

InChI

InChI=1S/C23H26ClNO4/c1-4-27-20-7-6-16(11-22(20)28-5-2)8-9-25-14-17-12-23(26)29-21-10-15(3)19(24)13-18(17)21/h6-7,10-13,25H,4-5,8-9,14H2,1-3H3/p+1