(4-methyl-1,4-diazepan-4-ium-1-yl)-(4,5,6,7-tetrahydro-1-benzothiophen-2-yl)methanone

Systemtic Name: (4-methyl-1,4-diazepan-4-ium-1-yl)-(4,5,6,7-tetrahydro-1-benzothiophen-2-yl)methanone Openeye Name: (4-methyl-1,4-diazepan-4-ium-1-yl)-(4,5,6,7-tetrahydrobenzothiophen-2-yl)methanone CAS Name: (4-methyl-1,4-diazepan-4-ium-1-yl)-(4,5,6,7-tetrahydro-1-benzothiophen-2-yl)methanone IUPAC Name: (4-methyl-1,4-diazepan-4-ium-1-yl)-(4,5,6,7-tetrahydro-1-benzothiophen-2-yl)methanone Traditional Name: (4-methyl-1,4-diazepan-4-ium-1-yl)-(4,5,6,7-tetrahydrobenzothiophen-2-yl)methanone Formula: C15H23N2OS+ MolecularWeight: 279.42092

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCCN(CC1)C(=O)C2=CC3=C(S2)CCCC3

Isomeric SMILES

C[NH+]1CCCN(CC1)C(=O)C2=CC3=C(S2)CCCC3

InChI

InChI=1S/C15H22N2OS/c1-16-7-4-8-17(10-9-16)15(18)14-11-12-5-2-3-6-13(12)19-14/h11H,2-10H2,1H3/p+1