3-[(Z)-3-[(2,2-diethyl-6-nitro-3-oxidanyl-3,4-dihydrochromen-4-yl)amino]-2-ethoxy-prop-1-enoxy]prop-1-en-1-one

Systemtic Name: 3-[(Z)-3-[(2,2-diethyl-6-nitro-3-oxidanyl-3,4-dihydrochromen-4-yl)amino]-2-ethoxy-prop-1-enoxy]prop-1-en-1-one Openeye Name: 3-[(Z)-3-[(2,2-diethyl-3-hydroxy-6-nitro-chroman-4-yl)amino]-2-ethoxy-prop-1-enoxy]prop-1-en-1-one CAS Name: 3-[(Z)-3-[(2,2-diethyl-3-hydroxy-6-nitro-3,4-dihydro-2H-1-benzopyran-4-yl)amino]-2-ethoxyprop-1-enoxy]-1-propen-1-one IUPAC Name: 3-[(Z)-3-[(2,2-diethyl-3-hydroxy-6-nitro-3,4-dihydrochromen-4-yl)amino]-2-ethoxyprop-1-enoxy]prop-1-en-1-one Traditional Name: 3-[(Z)-3-[(2,2-diethyl-3-hydroxy-6-nitro-chroman-4-yl)amino]-2-ethoxy-prop-1-enoxy]prop-1-en-1-one Formula: C21H28N2O7 MolecularWeight: 420.45622

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(C(C(C2=C(O1)C=CC(=C2)[N+](=O)[O-])NCC(=COCC=C=O)OCC)O)CC

Isomeric SMILES

CCC1(C(C(C2=C(O1)C=CC(=C2)[N+](=O)[O-])NC/C(=C/OCC=C=O)/OCC)O)CC

InChI

InChI=1S/C21H28N2O7/c1-4-21(5-2)20(25)19(17-12-15(23(26)27)8-9-18(17)30-21)22-13-16(29-6-3)14-28-11-7-10-24/h7-9,12,14,19-20,22,25H,4-6,11,13H2,1-3H3/b16-14-