2-(1H-indol-3-yl)ethyl-[(8-methyl-7-oxidanyl-2-oxidanylidene-chromen-4-yl)methyl]azanium

Systemtic Name: 2-(1H-indol-3-yl)ethyl-[(8-methyl-7-oxidanyl-2-oxidanylidene-chromen-4-yl)methyl]azanium Openeye Name: (7-hydroxy-8-methyl-2-oxo-chromen-4-yl)methyl-[2-(1H-indol-3-yl)ethyl]ammonium CAS Name: (7-hydroxy-8-methyl-2-oxo-1-benzopyran-4-yl)methyl-[2-(1H-indol-3-yl)ethyl]ammonium IUPAC Name: (7-hydroxy-8-methyl-2-oxochromen-4-yl)methyl-[2-(1H-indol-3-yl)ethyl]azanium Traditional Name: (7-hydroxy-2-keto-8-methyl-chromen-4-yl)methyl-[2-(1H-indol-3-yl)ethyl]ammonium Formula: C21H21N2O3+ MolecularWeight: 349.40304

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC2=C1OC(=O)C=C2C[NH2+]CCC3=CNC4=CC=CC=C43)O

Isomeric SMILES

CC1=C(C=CC2=C1OC(=O)C=C2C[NH2+]CCC3=CNC4=CC=CC=C43)O

InChI

InChI=1S/C21H20N2O3/c1-13-19(24)7-6-17-15(10-20(25)26-21(13)17)11-22-9-8-14-12-23-18-5-3-2-4-16(14)18/h2-7,10,12,22-24H,8-9,11H2,1H3/p+1