(5-bromanylthiophen-2-yl)methyl-[(7-oxidanyl-2-oxidanylidene-chromen-4-yl)methyl]-prop-2-enyl-azanium

Systemtic Name: (5-bromanylthiophen-2-yl)methyl-[(7-oxidanyl-2-oxidanylidene-chromen-4-yl)methyl]-prop-2-enyl-azanium Openeye Name: allyl-[(5-bromo-2-thienyl)methyl]-[(7-hydroxy-2-oxo-chromen-4-yl)methyl]ammonium CAS Name: (5-bromo-2-thiophenyl)methyl-[(7-hydroxy-2-oxo-1-benzopyran-4-yl)methyl]-prop-2-enylammonium IUPAC Name: (5-bromothiophen-2-yl)methyl-[(7-hydroxy-2-oxochromen-4-yl)methyl]-prop-2-enylazanium Traditional Name: allyl-[(5-bromo-2-thienyl)methyl]-[(7-hydroxy-2-keto-chromen-4-yl)methyl]ammonium Formula: C18H17BrNO3S+ MolecularWeight: 407.30148

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Descriptors Computed from Structure

Canonical SMILES:

C=CC[NH+](CC1=CC=C(S1)Br)CC2=CC(=O)OC3=C2C=CC(=C3)O

Isomeric SMILES

C=CC[NH+](CC1=CC=C(S1)Br)CC2=CC(=O)OC3=C2C=CC(=C3)O

InChI

InChI=1S/C18H16BrNO3S/c1-2-7-20(11-14-4-6-17(19)24-14)10-12-8-18(22)23-16-9-13(21)3-5-15(12)16/h2-6,8-9,21H,1,7,10-11H2/p+1