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

Systemtic Name: 2-azanyl-4-[4-methoxy-3-[(4-nitropyrazol-1-yl)methyl]phenyl]-5-oxidanylidene-1-phenyl-4,6,7,8-tetrahydroquinoline-3-carbonitrile Openeye Name: 2-amino-4-[4-methoxy-3-[(4-nitropyrazol-1-yl)methyl]phenyl]-5-oxo-1-phenyl-4,6,7,8-tetrahydroquinoline-3-carbonitrile CAS Name: 2-amino-4-[4-methoxy-3-[(4-nitro-1-pyrazolyl)methyl]phenyl]-5-oxo-1-phenyl-4,6,7,8-tetrahydroquinoline-3-carbonitrile IUPAC Name: 2-amino-4-[4-methoxy-3-[(4-nitropyrazol-1-yl)methyl]phenyl]-5-oxo-1-phenyl-4,6,7,8-tetrahydroquinoline-3-carbonitrile Traditional Name: 2-amino-5-keto-4-[4-methoxy-3-[(4-nitropyrazol-1-yl)methyl]phenyl]-1-phenyl-4,6,7,8-tetrahydroquinoline-3-carbonitrile Formula: C27H24N6O4 MolecularWeight: 496.51726

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2C(=C(N(C3=C2C(=O)CCC3)C4=CC=CC=C4)N)C#N)CN5C=C(C=N5)[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=C(C=C1)C2C(=C(N(C3=C2C(=O)CCC3)C4=CC=CC=C4)N)C#N)CN5C=C(C=N5)[N+](=O)[O-]

InChI

InChI=1S/C27H24N6O4/c1-37-24-11-10-17(12-18(24)15-31-16-20(14-30-31)33(35)36)25-21(13-28)27(29)32(19-6-3-2-4-7-19)22-8-5-9-23(34)26(22)25/h2-4,6-7,10-12,14,16,25H,5,8-9,15,29H2,1H3