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

Systemtic Name: 2-azanyl-4-[4-methoxy-3-[(4-nitropyrazol-1-yl)methyl]phenyl]-6,6-dimethyl-8-oxidanylidene-5,7-dihydro-4H-chromene-3-carbonitrile Openeye Name: 2-amino-4-[4-methoxy-3-[(4-nitropyrazol-1-yl)methyl]phenyl]-6,6-dimethyl-8-oxo-5,7-dihydro-4H-chromene-3-carbonitrile CAS Name: 2-amino-4-[4-methoxy-3-[(4-nitro-1-pyrazolyl)methyl]phenyl]-6,6-dimethyl-8-oxo-5,7-dihydro-4H-1-benzopyran-3-carbonitrile IUPAC Name: 2-amino-4-[4-methoxy-3-[(4-nitropyrazol-1-yl)methyl]phenyl]-6,6-dimethyl-8-oxo-5,7-dihydro-4H-chromene-3-carbonitrile Traditional Name: 2-amino-8-keto-4-[4-methoxy-3-[(4-nitropyrazol-1-yl)methyl]phenyl]-6,6-dimethyl-5,7-dihydro-4H-chromene-3-carbonitrile Formula: C23H23N5O5 MolecularWeight: 449.45922

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=C(C(=O)C1)OC(=C(C2C3=CC(=C(C=C3)OC)CN4C=C(C=N4)[N+](=O)[O-])C#N)N)C

Isomeric SMILES

CC1(CC2=C(C(=O)C1)OC(=C(C2C3=CC(=C(C=C3)OC)CN4C=C(C=N4)[N+](=O)[O-])C#N)N)C

InChI

InChI=1S/C23H23N5O5/c1-23(2)7-16-20(17(9-24)22(25)33-21(16)18(29)8-23)13-4-5-19(32-3)14(6-13)11-27-12-15(10-26-27)28(30)31/h4-6,10,12,20H,7-8,11,25H2,1-3H3