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

Systemtic Name: 3-methyl-1-[8-(3-nitrophenyl)carbonyl-4-thia-1,8-diazaspiro[4.5]decan-1-yl]butan-1-one Openeye Name: 3-methyl-1-[8-(3-nitrobenzoyl)-4-thia-1,8-diazaspiro[4.5]decan-1-yl]butan-1-one CAS Name: 3-methyl-1-[8-[(3-nitrophenyl)-oxomethyl]-4-thia-1,8-diazaspiro[4.5]decan-1-yl]-1-butanone IUPAC Name: 3-methyl-1-[8-(3-nitrobenzoyl)-4-thia-1,8-diazaspiro[4.5]decan-1-yl]butan-1-one Traditional Name: 3-methyl-1-[8-(3-nitrobenzoyl)-4-thia-1,8-diazaspiro[4.5]decan-1-yl]butan-1-one Formula: C19H25N3O4S MolecularWeight: 391.4845

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H25N3O4S/c1-14(2)12-17(23)21-10-11-27-19(21)6-8-20(9-7-19)18(24)15-4-3-5-16(13-15)22(25)26/h3-5,13-14H,6-12H2,1-2H3