methyl-[(3-oxidanylidenebenzo[f]chromen-1-yl)methyl]-(thiophen-3-ylmethyl)azanium

Systemtic Name: methyl-[(3-oxidanylidenebenzo[f]chromen-1-yl)methyl]-(thiophen-3-ylmethyl)azanium Openeye Name: methyl-[(3-oxobenzo[f]chromen-1-yl)methyl]-(3-thienylmethyl)ammonium CAS Name: methyl-[(3-oxo-1-benzo[f][1]benzopyranyl)methyl]-(3-thiophenylmethyl)ammonium IUPAC Name: methyl-[(3-oxobenzo[f]chromen-1-yl)methyl]-(thiophen-3-ylmethyl)azanium Traditional Name: (3-ketobenzo[f]chromen-1-yl)methyl-methyl-(3-thenyl)ammonium Formula: C20H18NO2S+ MolecularWeight: 336.42742

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CSC=C1)CC2=CC(=O)OC3=C2C4=CC=CC=C4C=C3

Isomeric SMILES

C[NH+](CC1=CSC=C1)CC2=CC(=O)OC3=C2C4=CC=CC=C4C=C3

InChI

InChI=1S/C20H17NO2S/c1-21(11-14-8-9-24-13-14)12-16-10-19(22)23-18-7-6-15-4-2-3-5-17(15)20(16)18/h2-10,13H,11-12H2,1H3/p+1