3,3-dimethyl-1-[1-(3-nitrophenyl)carbonyl-4-thia-1,8-diazaspiro[4.5]decan-8-yl]butan-1-one

Systemtic Name: 3,3-dimethyl-1-[1-(3-nitrophenyl)carbonyl-4-thia-1,8-diazaspiro[4.5]decan-8-yl]butan-1-one Openeye Name: 3,3-dimethyl-1-[1-(3-nitrobenzoyl)-4-thia-1,8-diazaspiro[4.5]decan-8-yl]butan-1-one CAS Name: 3,3-dimethyl-1-[1-[(3-nitrophenyl)-oxomethyl]-4-thia-1,8-diazaspiro[4.5]decan-8-yl]-1-butanone IUPAC Name: 3,3-dimethyl-1-[1-(3-nitrobenzoyl)-4-thia-1,8-diazaspiro[4.5]decan-8-yl]butan-1-one Traditional Name: 3,3-dimethyl-1-[1-(3-nitrobenzoyl)-4-thia-1,8-diazaspiro[4.5]decan-8-yl]butan-1-one Formula: C20H27N3O4S MolecularWeight: 405.51108

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CC(=O)N1CCC2(CC1)N(CCS2)C(=O)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)CC(=O)N1CCC2(CC1)N(CCS2)C(=O)C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C20H27N3O4S/c1-19(2,3)14-17(24)21-9-7-20(8-10-21)22(11-12-28-20)18(25)15-5-4-6-16(13-15)23(26)27/h4-6,13H,7-12,14H2,1-3H3