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

Systemtic Name: 3-cyclopentyl-1-[8-(4-methyl-3-nitro-phenyl)carbonyl-4-thia-1,8-diazaspiro[4.5]decan-1-yl]propan-1-one Openeye Name: 3-cyclopentyl-1-[8-(4-methyl-3-nitro-benzoyl)-4-thia-1,8-diazaspiro[4.5]decan-1-yl]propan-1-one CAS Name: 3-cyclopentyl-1-[8-[(4-methyl-3-nitrophenyl)-oxomethyl]-4-thia-1,8-diazaspiro[4.5]decan-1-yl]-1-propanone IUPAC Name: 3-cyclopentyl-1-[8-(4-methyl-3-nitrobenzoyl)-4-thia-1,8-diazaspiro[4.5]decan-1-yl]propan-1-one Traditional Name: 3-cyclopentyl-1-[8-(4-methyl-3-nitro-benzoyl)-4-thia-1,8-diazaspiro[4.5]decan-1-yl]propan-1-one Formula: C23H31N3O4S MolecularWeight: 445.57494

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)N2CCC3(CC2)N(CCS3)C(=O)CCC4CCCC4)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)N2CCC3(CC2)N(CCS3)C(=O)CCC4CCCC4)[N+](=O)[O-]

InChI

InChI=1S/C23H31N3O4S/c1-17-6-8-19(16-20(17)26(29)30)22(28)24-12-10-23(11-13-24)25(14-15-31-23)21(27)9-7-18-4-2-3-5-18/h6,8,16,18H,2-5,7,9-15H2,1H3