1-(2,2-diethyl-6-nitro-3-oxidanyl-3,4-dihydrochromen-4-yl)-3-hexoxy-2H-pyrrol-5-one

Systemtic Name: 1-(2,2-diethyl-6-nitro-3-oxidanyl-3,4-dihydrochromen-4-yl)-3-hexoxy-2H-pyrrol-5-one Openeye Name: 1-(2,2-diethyl-3-hydroxy-6-nitro-chroman-4-yl)-3-hexoxy-2H-pyrrol-5-one CAS Name: 1-(2,2-diethyl-3-hydroxy-6-nitro-3,4-dihydro-2H-1-benzopyran-4-yl)-3-hexoxy-2H-pyrrol-5-one IUPAC Name: 1-(2,2-diethyl-3-hydroxy-6-nitro-3,4-dihydrochromen-4-yl)-3-hexoxy-2H-pyrrol-5-one Traditional Name: 1-(2,2-diethyl-3-hydroxy-6-nitro-chroman-4-yl)-4-hexoxy-3-pyrrolin-2-one Formula: C23H32N2O6 MolecularWeight: 432.50998

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=CC(=O)N(C1)C2C(C(OC3=C2C=C(C=C3)[N+](=O)[O-])(CC)CC)O

Isomeric SMILES

CCCCCCOC1=CC(=O)N(C1)C2C(C(OC3=C2C=C(C=C3)[N+](=O)[O-])(CC)CC)O

InChI

InChI=1S/C23H32N2O6/c1-4-7-8-9-12-30-17-14-20(26)24(15-17)21-18-13-16(25(28)29)10-11-19(18)31-23(5-2,6-3)22(21)27/h10-11,13-14,21-22,27H,4-9,12,15H2,1-3H3