(2S)-5-azanyl-1-(4-methoxyphenyl)-2-(3-nitrophenyl)-2H-pyrrole-3,3,4-tricarbonitrile

Systemtic Name: (2S)-5-azanyl-1-(4-methoxyphenyl)-2-(3-nitrophenyl)-2H-pyrrole-3,3,4-tricarbonitrile Openeye Name: (2S)-5-amino-1-(4-methoxyphenyl)-2-(3-nitrophenyl)-2H-pyrrole-3,3,4-tricarbonitrile CAS Name: (2S)-5-amino-1-(4-methoxyphenyl)-2-(3-nitrophenyl)-2H-pyrrole-3,3,4-tricarbonitrile IUPAC Name: (2S)-5-amino-1-(4-methoxyphenyl)-2-(3-nitrophenyl)-2H-pyrrole-3,3,4-tricarbonitrile Traditional Name: (2S)-5-amino-1-(4-methoxyphenyl)-2-(3-nitrophenyl)-2-pyrroline-3,3,4-tricarbonitrile Formula: C20H14N6O3 MolecularWeight: 386.36356

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2C(C(C(=C2N)C#N)(C#N)C#N)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

COC1=CC=C(C=C1)N2[C@H](C(C(=C2N)C#N)(C#N)C#N)C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C20H14N6O3/c1-29-16-7-5-14(6-8-16)25-18(13-3-2-4-15(9-13)26(27)28)20(11-22,12-23)17(10-21)19(25)24/h2-9,18H,24H2,1H3/t18-/m0/s1