2-methoxy-6-nitro-4-[(E)-3-oxidanylidene-3-[3-(2-oxidanylidenepyrrolidin-1-yl)phenyl]prop-1-enyl]phenolate

Systemtic Name: 2-methoxy-6-nitro-4-[(E)-3-oxidanylidene-3-[3-(2-oxidanylidenepyrrolidin-1-yl)phenyl]prop-1-enyl]phenolate Openeye Name: 2-methoxy-6-nitro-4-[(E)-3-oxo-3-[3-(2-oxopyrrolidin-1-yl)phenyl]prop-1-enyl]phenolate CAS Name: 2-methoxy-6-nitro-4-[(E)-3-oxo-3-[3-(2-oxo-1-pyrrolidinyl)phenyl]prop-1-enyl]phenolate IUPAC Name: 2-methoxy-6-nitro-4-[(E)-3-oxo-3-[3-(2-oxopyrrolidin-1-yl)phenyl]prop-1-enyl]phenolate Traditional Name: 4-[(E)-3-keto-3-[3-(2-ketopyrrolidino)phenyl]prop-1-enyl]-2-methoxy-6-nitro-phenolate Formula: C20H17N2O6- MolecularWeight: 381.35878

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

COC1=CC(=CC(=C1[O-])[N+](=O)[O-])/C=C/C(=O)C2=CC(=CC=C2)N3CCCC3=O

InChI

InChI=1S/C20H18N2O6/c1-28-18-11-13(10-16(20(18)25)22(26)27)7-8-17(23)14-4-2-5-15(12-14)21-9-3-6-19(21)24/h2,4-5,7-8,10-12,25H,3,6,9H2,1H3/p-1/b8-7+