[3-[(3-methoxyphenyl)-(thiophen-2-ylmethyl)amino]-3-oxidanylidene-propyl]azanium

Systemtic Name: [3-[(3-methoxyphenyl)-(thiophen-2-ylmethyl)amino]-3-oxidanylidene-propyl]azanium Openeye Name: [3-[3-methoxy-N-(2-thienylmethyl)anilino]-3-oxo-propyl]ammonium CAS Name: [3-[3-methoxy-N-(thiophen-2-ylmethyl)anilino]-3-oxopropyl]ammonium IUPAC Name: [3-[3-methoxy-N-(thiophen-2-ylmethyl)anilino]-3-oxopropyl]azanium Traditional Name: [3-keto-3-[3-methoxy-N-(2-thenyl)anilino]propyl]ammonium Formula: C15H19N2O2S+ MolecularWeight: 291.38856

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)N(CC2=CC=CS2)C(=O)CC[NH3+]

Isomeric SMILES

COC1=CC=CC(=C1)N(CC2=CC=CS2)C(=O)CC[NH3+]

InChI

InChI=1S/C15H18N2O2S/c1-19-13-5-2-4-12(10-13)17(15(18)7-8-16)11-14-6-3-9-20-14/h2-6,9-10H,7-8,11,16H2,1H3/p+1