(5-chloranylthiophen-2-yl)methyl-(2-oxidanylidene-2-phenylazanyl-ethyl)-prop-2-enyl-azanium

Systemtic Name: (5-chloranylthiophen-2-yl)methyl-(2-oxidanylidene-2-phenylazanyl-ethyl)-prop-2-enyl-azanium Openeye Name: allyl-(2-anilino-2-oxo-ethyl)-[(5-chloro-2-thienyl)methyl]ammonium CAS Name: (2-anilino-2-oxoethyl)-[(5-chloro-2-thiophenyl)methyl]-prop-2-enylammonium IUPAC Name: (2-anilino-2-oxoethyl)-[(5-chlorothiophen-2-yl)methyl]-prop-2-enylazanium Traditional Name: allyl-(2-anilino-2-keto-ethyl)-[(5-chloro-2-thienyl)methyl]ammonium Formula: C16H18ClN2OS+ MolecularWeight: 321.84492

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Descriptors Computed from Structure

Canonical SMILES:

C=CC[NH+](CC1=CC=C(S1)Cl)CC(=O)NC2=CC=CC=C2

Isomeric SMILES

C=CC[NH+](CC1=CC=C(S1)Cl)CC(=O)NC2=CC=CC=C2

InChI

InChI=1S/C16H17ClN2OS/c1-2-10-19(11-14-8-9-15(17)21-14)12-16(20)18-13-6-4-3-5-7-13/h2-9H,1,10-12H2,(H,18,20)/p+1