methyl-[(4R)-7-oxidanylidene-1-prop-2-enyl-azepan-4-yl]-(thiophen-3-ylmethyl)azanium

Systemtic Name: methyl-[(4R)-7-oxidanylidene-1-prop-2-enyl-azepan-4-yl]-(thiophen-3-ylmethyl)azanium Openeye Name: [(4R)-1-allyl-7-oxo-azepan-4-yl]-methyl-(3-thienylmethyl)ammonium CAS Name: methyl-[(4R)-7-oxo-1-prop-2-enyl-4-azepanyl]-(3-thiophenylmethyl)ammonium IUPAC Name: methyl-[(4R)-7-oxo-1-prop-2-enylazepan-4-yl]-(thiophen-3-ylmethyl)azanium Traditional Name: [(4R)-1-allyl-7-keto-azepan-4-yl]-methyl-(3-thenyl)ammonium Formula: C15H23N2OS+ MolecularWeight: 279.42092

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CSC=C1)C2CCC(=O)N(CC2)CC=C

Isomeric SMILES

C[NH+](CC1=CSC=C1)[C@@H]2CCC(=O)N(CC2)CC=C

InChI

InChI=1S/C15H22N2OS/c1-3-8-17-9-6-14(4-5-15(17)18)16(2)11-13-7-10-19-12-13/h3,7,10,12,14H,1,4-6,8-9,11H2,2H3/p+1/t14-/m1/s1