2-azanyl-4-[3-[(4-bromanyl-5-methyl-3-nitro-pyrazol-1-yl)methyl]-4-methoxy-phenyl]-7,7-dimethyl-5-oxidanylidene-6,8-dihydro-4H-chromene-3-carbonitrile

Systemtic Name: 2-azanyl-4-[3-[(4-bromanyl-5-methyl-3-nitro-pyrazol-1-yl)methyl]-4-methoxy-phenyl]-7,7-dimethyl-5-oxidanylidene-6,8-dihydro-4H-chromene-3-carbonitrile Openeye Name: 2-amino-4-[3-[(4-bromo-5-methyl-3-nitro-pyrazol-1-yl)methyl]-4-methoxy-phenyl]-7,7-dimethyl-5-oxo-6,8-dihydro-4H-chromene-3-carbonitrile CAS Name: 2-amino-4-[3-[(4-bromo-5-methyl-3-nitro-1-pyrazolyl)methyl]-4-methoxyphenyl]-7,7-dimethyl-5-oxo-6,8-dihydro-4H-1-benzopyran-3-carbonitrile IUPAC Name: 2-amino-4-[3-[(4-bromo-5-methyl-3-nitropyrazol-1-yl)methyl]-4-methoxyphenyl]-7,7-dimethyl-5-oxo-6,8-dihydro-4H-chromene-3-carbonitrile Traditional Name: 2-amino-4-[3-[(4-bromo-5-methyl-3-nitro-pyrazol-1-yl)methyl]-4-methoxy-phenyl]-5-keto-7,7-dimethyl-6,8-dihydro-4H-chromene-3-carbonitrile Formula: C24H24BrN5O5 MolecularWeight: 542.38186

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC2=C(C=CC(=C2)C3C(=C(OC4=C3C(=O)CC(C4)(C)C)N)C#N)OC)[N+](=O)[O-])Br

Isomeric SMILES

CC1=C(C(=NN1CC2=C(C=CC(=C2)C3C(=C(OC4=C3C(=O)CC(C4)(C)C)N)C#N)OC)[N+](=O)[O-])Br

InChI

InChI=1S/C24H24BrN5O5/c1-12-21(25)23(30(32)33)28-29(12)11-14-7-13(5-6-17(14)34-4)19-15(10-26)22(27)35-18-9-24(2,3)8-16(31)20(18)19/h5-7,19H,8-9,11,27H2,1-4H3