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

Systemtic Name: 1-[1-(3-nitrophenyl)carbonyl-4-thia-1,8-diazaspiro[4.5]decan-8-yl]-2-phenyl-butan-1-one Openeye Name: 1-[1-(3-nitrobenzoyl)-4-thia-1,8-diazaspiro[4.5]decan-8-yl]-2-phenyl-butan-1-one CAS Name: 1-[1-[(3-nitrophenyl)-oxomethyl]-4-thia-1,8-diazaspiro[4.5]decan-8-yl]-2-phenyl-1-butanone IUPAC Name: 1-[1-(3-nitrobenzoyl)-4-thia-1,8-diazaspiro[4.5]decan-8-yl]-2-phenylbutan-1-one Traditional Name: 1-[1-(3-nitrobenzoyl)-4-thia-1,8-diazaspiro[4.5]decan-8-yl]-2-phenyl-butan-1-one Formula: C24H27N3O4S MolecularWeight: 453.55388

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC=CC=C1)C(=O)N2CCC3(CC2)N(CCS3)C(=O)C4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

CCC(C1=CC=CC=C1)C(=O)N2CCC3(CC2)N(CCS3)C(=O)C4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C24H27N3O4S/c1-2-21(18-7-4-3-5-8-18)23(29)25-13-11-24(12-14-25)26(15-16-32-24)22(28)19-9-6-10-20(17-19)27(30)31/h3-10,17,21H,2,11-16H2,1H3