N-(2,4-dinitrophenyl)-6,10-dimethoxy-8-pyridin-2-ylsulfanyl-4-oxaspiro[4.5]deca-6,9-dien-8-amine

Systemtic Name: N-(2,4-dinitrophenyl)-6,10-dimethoxy-8-pyridin-2-ylsulfanyl-4-oxaspiro[4.5]deca-6,9-dien-8-amine Openeye Name: N-(2,4-dinitrophenyl)-6,10-dimethoxy-8-(2-pyridylsulfanyl)-4-oxaspiro[4.5]deca-6,9-dien-8-amine CAS Name: N-(2,4-dinitrophenyl)-6,10-dimethoxy-8-(2-pyridinylthio)-4-oxaspiro[4.5]deca-6,9-dien-8-amine IUPAC Name: N-(2,4-dinitrophenyl)-6,10-dimethoxy-8-pyridin-2-ylsulfanyl-4-oxaspiro[4.5]deca-6,9-dien-8-amine Traditional Name: [6,10-dimethoxy-8-(2-pyridylthio)-4-oxaspiro[4.5]deca-6,9-dien-8-yl]-(2,4-dinitrophenyl)amine Formula: C22H22N4O7S MolecularWeight: 486.49768

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(C=C(C12CCCO2)OC)(NC3=C(C=C(C=C3)[N+](=O)[O-])[N+](=O)[O-])SC4=CC=CC=N4

Isomeric SMILES

COC1=CC(C=C(C12CCCO2)OC)(NC3=C(C=C(C=C3)[N+](=O)[O-])[N+](=O)[O-])SC4=CC=CC=N4

InChI

InChI=1S/C22H22N4O7S/c1-31-18-13-21(34-20-6-3-4-10-23-20,14-19(32-2)22(18)9-5-11-33-22)24-16-8-7-15(25(27)28)12-17(16)26(29)30/h3-4,6-8,10,12-14,24H,5,9,11H2,1-2H3