(5-chloranylthiophen-2-yl)methyl-[(2R)-1-[(2-methoxyphenyl)amino]-1-oxidanylidene-propan-2-yl]-prop-2-enyl-azanium

Systemtic Name: (5-chloranylthiophen-2-yl)methyl-[(2R)-1-[(2-methoxyphenyl)amino]-1-oxidanylidene-propan-2-yl]-prop-2-enyl-azanium Openeye Name: allyl-[(5-chloro-2-thienyl)methyl]-[(1R)-2-(2-methoxyanilino)-1-methyl-2-oxo-ethyl]ammonium CAS Name: (5-chloro-2-thiophenyl)methyl-[(2R)-1-(2-methoxyanilino)-1-oxopropan-2-yl]-prop-2-enylammonium IUPAC Name: (5-chlorothiophen-2-yl)methyl-[(2R)-1-(2-methoxyanilino)-1-oxopropan-2-yl]-prop-2-enylazanium Traditional Name: allyl-[(5-chloro-2-thienyl)methyl]-[(1R)-2-keto-1-methyl-2-(o-anisidino)ethyl]ammonium Formula: C18H22ClN2O2S+ MolecularWeight: 365.89748

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=CC=C1OC)[NH+](CC=C)CC2=CC=C(S2)Cl

Isomeric SMILES

C[C@H](C(=O)NC1=CC=CC=C1OC)[NH+](CC=C)CC2=CC=C(S2)Cl

InChI

InChI=1S/C18H21ClN2O2S/c1-4-11-21(12-14-9-10-17(19)24-14)13(2)18(22)20-15-7-5-6-8-16(15)23-3/h4-10,13H,1,11-12H2,2-3H3,(H,20,22)/p+1/t13-/m1/s1