(5-nitrothiophen-3-yl)-[3-[(E)-2-phenylethenyl]pyrazol-1-yl]methanone

Systemtic Name: (5-nitrothiophen-3-yl)-[3-[(E)-2-phenylethenyl]pyrazol-1-yl]methanone Openeye Name: (5-nitro-3-thienyl)-[3-[(E)-styryl]pyrazol-1-yl]methanone CAS Name: (5-nitro-3-thiophenyl)-[3-[(E)-2-phenylethenyl]-1-pyrazolyl]methanone IUPAC Name: (5-nitrothiophen-3-yl)-[3-[(E)-2-phenylethenyl]pyrazol-1-yl]methanone Traditional Name: (5-nitro-3-thienyl)-[3-[(E)-styryl]pyrazol-1-yl]methanone Formula: C16H11N3O3S MolecularWeight: 325.34184

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C=CC2=NN(C=C2)C(=O)C3=CSC(=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)/C=C/C2=NN(C=C2)C(=O)C3=CSC(=C3)[N+](=O)[O-]

InChI

InChI=1S/C16H11N3O3S/c20-16(13-10-15(19(21)22)23-11-13)18-9-8-14(17-18)7-6-12-4-2-1-3-5-12/h1-11H/b7-6+