(4-bromophenyl)methyl-[2-[(3-cyano-4,5-dimethyl-furan-2-yl)amino]-2-oxidanylidene-ethyl]-methyl-azanium

Systemtic Name: (4-bromophenyl)methyl-[2-[(3-cyano-4,5-dimethyl-furan-2-yl)amino]-2-oxidanylidene-ethyl]-methyl-azanium Openeye Name: (4-bromophenyl)methyl-[2-[(3-cyano-4,5-dimethyl-2-furyl)amino]-2-oxo-ethyl]-methyl-ammonium CAS Name: (4-bromophenyl)methyl-[2-[(3-cyano-4,5-dimethyl-2-furanyl)amino]-2-oxoethyl]-methylammonium IUPAC Name: (4-bromophenyl)methyl-[2-[(3-cyano-4,5-dimethylfuran-2-yl)amino]-2-oxoethyl]-methylazanium Traditional Name: (4-bromobenzyl)-[2-[(3-cyano-4,5-dimethyl-2-furyl)amino]-2-keto-ethyl]-methyl-ammonium Formula: C17H19BrN3O2+ MolecularWeight: 377.25566

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC(=C1C#N)NC(=O)C[NH+](C)CC2=CC=C(C=C2)Br)C

Isomeric SMILES

CC1=C(OC(=C1C#N)NC(=O)C[NH+](C)CC2=CC=C(C=C2)Br)C

InChI

InChI=1S/C17H18BrN3O2/c1-11-12(2)23-17(15(11)8-19)20-16(22)10-21(3)9-13-4-6-14(18)7-5-13/h4-7H,9-10H2,1-3H3,(H,20,22)/p+1