8-(1-benzothiophen-2-ylmethyl)-2-methyl-4-(2-methylpropyl)-2,4-diaza-8-azoniaspiro[4.5]decane-1,3-dione

Systemtic Name: 8-(1-benzothiophen-2-ylmethyl)-2-methyl-4-(2-methylpropyl)-2,4-diaza-8-azoniaspiro[4.5]decane-1,3-dione Openeye Name: 8-(benzothiophen-2-ylmethyl)-4-isobutyl-2-methyl-2,4-diaza-8-azoniaspiro[4.5]decane-1,3-dione CAS Name: 8-(1-benzothiophen-2-ylmethyl)-2-methyl-4-(2-methylpropyl)-2,4-diaza-8-azoniaspiro[4.5]decane-1,3-dione IUPAC Name: 8-(1-benzothiophen-2-ylmethyl)-2-methyl-4-(2-methylpropyl)-2,4-diaza-8-azoniaspiro[4.5]decane-1,3-dione Traditional Name: 8-(benzothiophen-2-ylmethyl)-4-isobutyl-2-methyl-2,4-diaza-8-azoniaspiro[4.5]decane-1,3-quinone Formula: C21H28N3O2S+ MolecularWeight: 386.53092

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C(=O)N(C(=O)C12CC[NH+](CC2)CC3=CC4=CC=CC=C4S3)C

Isomeric SMILES

CC(C)CN1C(=O)N(C(=O)C12CC[NH+](CC2)CC3=CC4=CC=CC=C4S3)C

InChI

InChI=1S/C21H27N3O2S/c1-15(2)13-24-20(26)22(3)19(25)21(24)8-10-23(11-9-21)14-17-12-16-6-4-5-7-18(16)27-17/h4-7,12,15H,8-11,13-14H2,1-3H3/p+1