1-[8-(2-chloranyl-4-nitro-phenyl)carbonyl-4-thia-1,8-diazaspiro[4.5]decan-1-yl]-3-methyl-butan-1-one

Systemtic Name: 1-[8-(2-chloranyl-4-nitro-phenyl)carbonyl-4-thia-1,8-diazaspiro[4.5]decan-1-yl]-3-methyl-butan-1-one Openeye Name: 1-[8-(2-chloro-4-nitro-benzoyl)-4-thia-1,8-diazaspiro[4.5]decan-1-yl]-3-methyl-butan-1-one CAS Name: 1-[8-[(2-chloro-4-nitrophenyl)-oxomethyl]-4-thia-1,8-diazaspiro[4.5]decan-1-yl]-3-methyl-1-butanone IUPAC Name: 1-[8-(2-chloro-4-nitrobenzoyl)-4-thia-1,8-diazaspiro[4.5]decan-1-yl]-3-methylbutan-1-one Traditional Name: 1-[8-(2-chloro-4-nitro-benzoyl)-4-thia-1,8-diazaspiro[4.5]decan-1-yl]-3-methyl-butan-1-one Formula: C19H24ClN3O4S MolecularWeight: 425.92956

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)N1CCSC12CCN(CC2)C(=O)C3=C(C=C(C=C3)[N+](=O)[O-])Cl

Isomeric SMILES

CC(C)CC(=O)N1CCSC12CCN(CC2)C(=O)C3=C(C=C(C=C3)[N+](=O)[O-])Cl

InChI

InChI=1S/C19H24ClN3O4S/c1-13(2)11-17(24)22-9-10-28-19(22)5-7-21(8-6-19)18(25)15-4-3-14(23(26)27)12-16(15)20/h3-4,12-13H,5-11H2,1-2H3