4-[[4-methoxy-3-(2-oxidanylidenepyrrolidin-1-yl)phenyl]amino]-3-nitro-benzenecarbonitrile

Systemtic Name: 4-[[4-methoxy-3-(2-oxidanylidenepyrrolidin-1-yl)phenyl]amino]-3-nitro-benzenecarbonitrile Openeye Name: 4-[4-methoxy-3-(2-oxopyrrolidin-1-yl)anilino]-3-nitro-benzonitrile CAS Name: 4-[4-methoxy-3-(2-oxo-1-pyrrolidinyl)anilino]-3-nitrobenzonitrile IUPAC Name: 4-[4-methoxy-3-(2-oxopyrrolidin-1-yl)anilino]-3-nitrobenzonitrile Traditional Name: 4-[3-(2-ketopyrrolidino)-4-methoxy-anilino]-3-nitro-benzonitrile Formula: C18H16N4O4 MolecularWeight: 352.34404

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC2=C(C=C(C=C2)C#N)[N+](=O)[O-])N3CCCC3=O

Isomeric SMILES

COC1=C(C=C(C=C1)NC2=C(C=C(C=C2)C#N)[N+](=O)[O-])N3CCCC3=O

InChI

InChI=1S/C18H16N4O4/c1-26-17-7-5-13(10-16(17)21-8-2-3-18(21)23)20-14-6-4-12(11-19)9-15(14)22(24)25/h4-7,9-10,20H,2-3,8H2,1H3