2-azanyl-4-[3-[(4-bromanyl-5-methyl-3-nitro-pyrazol-1-yl)methyl]-4-methoxy-phenyl]-5-oxidanylidene-4H-pyrano[3,2-c]chromene-3-carbonitrile

Systemtic Name: 2-azanyl-4-[3-[(4-bromanyl-5-methyl-3-nitro-pyrazol-1-yl)methyl]-4-methoxy-phenyl]-5-oxidanylidene-4H-pyrano[3,2-c]chromene-3-carbonitrile Openeye Name: 2-amino-4-[3-[(4-bromo-5-methyl-3-nitro-pyrazol-1-yl)methyl]-4-methoxy-phenyl]-5-oxo-4H-pyrano[3,2-c]chromene-3-carbonitrile CAS Name: 2-amino-4-[3-[(4-bromo-5-methyl-3-nitro-1-pyrazolyl)methyl]-4-methoxyphenyl]-5-oxo-4H-pyrano[3,2-c][1]benzopyran-3-carbonitrile IUPAC Name: 2-amino-4-[3-[(4-bromo-5-methyl-3-nitropyrazol-1-yl)methyl]-4-methoxyphenyl]-5-oxo-4H-pyrano[3,2-c]chromene-3-carbonitrile Traditional Name: 2-amino-4-[3-[(4-bromo-5-methyl-3-nitro-pyrazol-1-yl)methyl]-4-methoxy-phenyl]-5-keto-4H-pyrano[3,2-c]chromene-3-carbonitrile Formula: C25H18BrN5O6 MolecularWeight: 564.34432

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC2=C(C=CC(=C2)C3C(=C(OC4=C3C(=O)OC5=CC=CC=C54)N)C#N)OC)[N+](=O)[O-])Br

Isomeric SMILES

CC1=C(C(=NN1CC2=C(C=CC(=C2)C3C(=C(OC4=C3C(=O)OC5=CC=CC=C54)N)C#N)OC)[N+](=O)[O-])Br

InChI

InChI=1S/C25H18BrN5O6/c1-12-21(26)24(31(33)34)29-30(12)11-14-9-13(7-8-17(14)35-2)19-16(10-27)23(28)37-22-15-5-3-4-6-18(15)36-25(32)20(19)22/h3-9,19H,11,28H2,1-2H3