(4S)-6-azanyl-4-(5-chloranyl-2-nitro-phenyl)-3-methyl-1-phenyl-4H-pyrano[2,3-c]pyrazole-5-carbonitrile

Systemtic Name: (4S)-6-azanyl-4-(5-chloranyl-2-nitro-phenyl)-3-methyl-1-phenyl-4H-pyrano[2,3-c]pyrazole-5-carbonitrile Openeye Name: (4S)-6-amino-4-(5-chloro-2-nitro-phenyl)-3-methyl-1-phenyl-4H-pyrano[2,3-c]pyrazole-5-carbonitrile CAS Name: (4S)-6-amino-4-(5-chloro-2-nitrophenyl)-3-methyl-1-phenyl-4H-pyrano[2,3-c]pyrazole-5-carbonitrile IUPAC Name: (4S)-6-amino-4-(5-chloro-2-nitrophenyl)-3-methyl-1-phenyl-4H-pyrano[2,3-c]pyrazole-5-carbonitrile Traditional Name: (4S)-6-amino-4-(5-chloro-2-nitro-phenyl)-3-methyl-1-phenyl-4H-pyrano[2,3-c]pyrazole-5-carbonitrile Formula: C20H14ClN5O3 MolecularWeight: 407.80986

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C2=C1C(C(=C(O2)N)C#N)C3=C(C=CC(=C3)Cl)[N+](=O)[O-])C4=CC=CC=C4

Isomeric SMILES

CC1=NN(C2=C1[C@@H](C(=C(O2)N)C#N)C3=C(C=CC(=C3)Cl)[N+](=O)[O-])C4=CC=CC=C4

InChI

InChI=1S/C20H14ClN5O3/c1-11-17-18(14-9-12(21)7-8-16(14)26(27)28)15(10-22)19(23)29-20(17)25(24-11)13-5-3-2-4-6-13/h2-9,18H,23H2,1H3/t18-/m1/s1