7-[(4-phenethylpiperidin-1-ium-1-yl)methyl]-7,9-diazaspiro[4.4]nonane-6,8-dione

Systemtic Name: 7-[(4-phenethylpiperidin-1-ium-1-yl)methyl]-7,9-diazaspiro[4.4]nonane-6,8-dione Openeye Name: 7-[(4-phenethylpiperidin-1-ium-1-yl)methyl]-7,9-diazaspiro[4.4]nonane-6,8-dione CAS Name: 7-[(4-phenethyl-1-piperidin-1-iumyl)methyl]-7,9-diazaspiro[4.4]nonane-6,8-dione IUPAC Name: 7-[(4-phenethylpiperidin-1-ium-1-yl)methyl]-7,9-diazaspiro[4.4]nonane-6,8-dione Traditional Name: 7-[(4-phenethylpiperidin-1-ium-1-yl)methyl]-7,9-diazaspiro[4.4]nonane-6,8-quinone Formula: C21H30N3O2+ MolecularWeight: 356.4818

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2(C1)C(=O)N(C(=O)N2)C[NH+]3CCC(CC3)CCC4=CC=CC=C4

Isomeric SMILES

C1CCC2(C1)C(=O)N(C(=O)N2)C[NH+]3CCC(CC3)CCC4=CC=CC=C4

InChI

InChI=1S/C21H29N3O2/c25-19-21(12-4-5-13-21)22-20(26)24(19)16-23-14-10-18(11-15-23)9-8-17-6-2-1-3-7-17/h1-3,6-7,18H,4-5,8-16H2,(H,22,26)/p+1