4-[2,5-dimethyl-3-[(Z)-2-(3-methyl-4-nitro-1,2-oxazol-5-yl)ethenyl]pyrrol-1-yl]benzoate

Systemtic Name: 4-[2,5-dimethyl-3-[(Z)-2-(3-methyl-4-nitro-1,2-oxazol-5-yl)ethenyl]pyrrol-1-yl]benzoate Openeye Name: 4-[2,5-dimethyl-3-[(Z)-2-(3-methyl-4-nitro-isoxazol-5-yl)vinyl]pyrrol-1-yl]benzoate CAS Name: 4-[2,5-dimethyl-3-[(Z)-2-(3-methyl-4-nitro-5-isoxazolyl)ethenyl]-1-pyrrolyl]benzoate IUPAC Name: 4-[2,5-dimethyl-3-[(Z)-2-(3-methyl-4-nitro-1,2-oxazol-5-yl)ethenyl]pyrrol-1-yl]benzoate Traditional Name: 4-[2,5-dimethyl-3-[(Z)-2-(3-methyl-4-nitro-isoxazol-5-yl)vinyl]pyrrol-1-yl]benzoate Formula: C19H16N3O5- MolecularWeight: 366.34744

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2=CC=C(C=C2)C(=O)[O-])C)C=CC3=C(C(=NO3)C)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(N1C2=CC=C(C=C2)C(=O)[O-])C)/C=C\C3=C(C(=NO3)C)[N+](=O)[O-]

InChI

InChI=1S/C19H17N3O5/c1-11-10-15(6-9-17-18(22(25)26)12(2)20-27-17)13(3)21(11)16-7-4-14(5-8-16)19(23)24/h4-10H,1-3H3,(H,23,24)/p-1/b9-6-