(3-methoxy-4-nitro-1H-pyrazol-5-yl)carbonyl-(4-methyl-2-oxidanyl-5,6,8,8a-tetrahydrochromen-7-ylidene)azanium

Systemtic Name: (3-methoxy-4-nitro-1H-pyrazol-5-yl)carbonyl-(4-methyl-2-oxidanyl-5,6,8,8a-tetrahydrochromen-7-ylidene)azanium Openeye Name: (2-hydroxy-4-methyl-5,6,8,8a-tetrahydrochromen-7-ylidene)-(3-methoxy-4-nitro-1H-pyrazole-5-carbonyl)ammonium CAS Name: (2-hydroxy-4-methyl-5,6,8,8a-tetrahydro-1-benzopyran-7-ylidene)-[(3-methoxy-4-nitro-1H-pyrazol-5-yl)-oxomethyl]ammonium IUPAC Name: (2-hydroxy-4-methyl-5,6,8,8a-tetrahydrochromen-7-ylidene)-(3-methoxy-4-nitro-1H-pyrazole-5-carbonyl)azanium Traditional Name: (2-hydroxy-4-methyl-5,6,8,8a-tetrahydrochromen-7-ylidene)-(3-methoxy-4-nitro-1H-pyrazole-5-carbonyl)ammonium Formula: C15H17N4O6+ MolecularWeight: 349.31868

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2CCC(=[NH+]C(=O)C3=C(C(=NN3)OC)[N+](=O)[O-])CC2OC(=C1)O

Isomeric SMILES

CC1=C2CCC(=[NH+]C(=O)C3=C(C(=NN3)OC)[N+](=O)[O-])CC2OC(=C1)O

InChI

InChI=1S/C15H16N4O6/c1-7-5-11(20)25-10-6-8(3-4-9(7)10)16-14(21)12-13(19(22)23)15(24-2)18-17-12/h5,10,20H,3-4,6H2,1-2H3,(H,17,18)/p+1