3-[(E)-3-[(2,2-dimethyl-6-nitro-3-oxidanyl-3,4-dihydrochromen-4-yl)amino]-2-propan-2-yloxy-prop-1-enoxy]prop-1-en-1-one

Systemtic Name: 3-[(E)-3-[(2,2-dimethyl-6-nitro-3-oxidanyl-3,4-dihydrochromen-4-yl)amino]-2-propan-2-yloxy-prop-1-enoxy]prop-1-en-1-one Openeye Name: 3-[(E)-3-[(3-hydroxy-2,2-dimethyl-6-nitro-chroman-4-yl)amino]-2-isopropoxy-prop-1-enoxy]prop-1-en-1-one CAS Name: 3-[(E)-3-[(3-hydroxy-2,2-dimethyl-6-nitro-3,4-dihydro-2H-1-benzopyran-4-yl)amino]-2-propan-2-yloxyprop-1-enoxy]-1-propen-1-one IUPAC Name: 3-[(E)-3-[(3-hydroxy-2,2-dimethyl-6-nitro-3,4-dihydrochromen-4-yl)amino]-2-propan-2-yloxyprop-1-enoxy]prop-1-en-1-one Traditional Name: 3-[(E)-3-[(3-hydroxy-2,2-dimethyl-6-nitro-chroman-4-yl)amino]-2-isopropoxy-prop-1-enoxy]prop-1-en-1-one Formula: C20H26N2O7 MolecularWeight: 406.42964

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=COCC=C=O)CNC1C(C(OC2=C1C=C(C=C2)[N+](=O)[O-])(C)C)O

Isomeric SMILES

CC(C)O/C(=C/OCC=C=O)/CNC1C(C(OC2=C1C=C(C=C2)[N+](=O)[O-])(C)C)O

InChI

InChI=1S/C20H26N2O7/c1-13(2)28-15(12-27-9-5-8-23)11-21-18-16-10-14(22(25)26)6-7-17(16)29-20(3,4)19(18)24/h5-7,10,12-13,18-19,21,24H,9,11H2,1-4H3/b15-12+