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

Systemtic Name: 1-[1-(4-nitrophenyl)carbonyl-4-thia-1,8-diazaspiro[4.5]decan-8-yl]heptan-1-one Openeye Name: 1-[1-(4-nitrobenzoyl)-4-thia-1,8-diazaspiro[4.5]decan-8-yl]heptan-1-one CAS Name: 1-[1-[(4-nitrophenyl)-oxomethyl]-4-thia-1,8-diazaspiro[4.5]decan-8-yl]-1-heptanone IUPAC Name: 1-[1-(4-nitrobenzoyl)-4-thia-1,8-diazaspiro[4.5]decan-8-yl]heptan-1-one Traditional Name: 1-[1-(4-nitrobenzoyl)-4-thia-1,8-diazaspiro[4.5]decan-8-yl]heptan-1-one Formula: C21H29N3O4S MolecularWeight: 419.53766

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H29N3O4S/c1-2-3-4-5-6-19(25)22-13-11-21(12-14-22)23(15-16-29-21)20(26)17-7-9-18(10-8-17)24(27)28/h7-10H,2-6,11-16H2,1H3