6-methyl-3-[(E)-3-[3-(4-nitrophenyl)-1-phenyl-pyrazol-4-yl]prop-2-enoyl]pyran-2,4-dione

Systemtic Name: 6-methyl-3-[(E)-3-[3-(4-nitrophenyl)-1-phenyl-pyrazol-4-yl]prop-2-enoyl]pyran-2,4-dione Openeye Name: 6-methyl-3-[(E)-3-[3-(4-nitrophenyl)-1-phenyl-pyrazol-4-yl]prop-2-enoyl]pyran-2,4-dione CAS Name: 6-methyl-3-[(E)-3-[3-(4-nitrophenyl)-1-phenyl-4-pyrazolyl]-1-oxoprop-2-enyl]pyran-2,4-dione IUPAC Name: 6-methyl-3-[(E)-3-[3-(4-nitrophenyl)-1-phenylpyrazol-4-yl]prop-2-enoyl]pyran-2,4-dione Traditional Name: 6-methyl-3-[(E)-3-[3-(4-nitrophenyl)-1-phenyl-pyrazol-4-yl]acryloyl]pyran-2,4-quinone Formula: C24H17N3O6 MolecularWeight: 443.40828

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)C(C(=O)O1)C(=O)C=CC2=CN(N=C2C3=CC=C(C=C3)[N+](=O)[O-])C4=CC=CC=C4

Isomeric SMILES

CC1=CC(=O)C(C(=O)O1)C(=O)/C=C/C2=CN(N=C2C3=CC=C(C=C3)[N+](=O)[O-])C4=CC=CC=C4

InChI

InChI=1S/C24H17N3O6/c1-15-13-21(29)22(24(30)33-15)20(28)12-9-17-14-26(18-5-3-2-4-6-18)25-23(17)16-7-10-19(11-8-16)27(31)32/h2-14,22H,1H3/b12-9+