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

Systemtic Name: 1-(3-methoxyphenyl)-8-(4-nitrophenyl)carbonyl-4-thia-1,8-diazaspiro[4.5]decan-2-one Openeye Name: 1-(3-methoxyphenyl)-8-(4-nitrobenzoyl)-4-thia-1,8-diazaspiro[4.5]decan-2-one CAS Name: 1-(3-methoxyphenyl)-8-[(4-nitrophenyl)-oxomethyl]-4-thia-1,8-diazaspiro[4.5]decan-2-one IUPAC Name: 1-(3-methoxyphenyl)-8-(4-nitrobenzoyl)-4-thia-1,8-diazaspiro[4.5]decan-2-one Traditional Name: 1-(3-methoxyphenyl)-8-(4-nitrobenzoyl)-4-thia-1,8-diazaspiro[4.5]decan-2-one Formula: C21H21N3O5S MolecularWeight: 427.47354

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)N2C(=O)CSC23CCN(CC3)C(=O)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

COC1=CC=CC(=C1)N2C(=O)CSC23CCN(CC3)C(=O)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C21H21N3O5S/c1-29-18-4-2-3-17(13-18)23-19(25)14-30-21(23)9-11-22(12-10-21)20(26)15-5-7-16(8-6-15)24(27)28/h2-8,13H,9-12,14H2,1H3