4-[(E)-3-(4-methoxyphenyl)-3-oxidanylidene-prop-1-enyl]-1-phenyl-N-(phenylmethyl)pyrazole-3-carboxamide

Systemtic Name: 4-[(E)-3-(4-methoxyphenyl)-3-oxidanylidene-prop-1-enyl]-1-phenyl-N-(phenylmethyl)pyrazole-3-carboxamide Openeye Name: N-benzyl-4-[(E)-3-(4-methoxyphenyl)-3-oxo-prop-1-enyl]-1-phenyl-pyrazole-3-carboxamide CAS Name: 4-[(E)-3-(4-methoxyphenyl)-3-oxoprop-1-enyl]-1-phenyl-N-(phenylmethyl)-3-pyrazolecarboxamide IUPAC Name: N-benzyl-4-[(E)-3-(4-methoxyphenyl)-3-oxoprop-1-enyl]-1-phenylpyrazole-3-carboxamide Traditional Name: N-benzyl-4-[(E)-3-keto-3-(4-methoxyphenyl)prop-1-enyl]-1-phenyl-pyrazole-3-carboxamide Formula: C27H23N3O3 MolecularWeight: 437.48982

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)C=CC2=CN(N=C2C(=O)NCC3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)/C=C/C2=CN(N=C2C(=O)NCC3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C27H23N3O3/c1-33-24-15-12-21(13-16-24)25(31)17-14-22-19-30(23-10-6-3-7-11-23)29-26(22)27(32)28-18-20-8-4-2-5-9-20/h2-17,19H,18H2,1H3,(H,28,32)/b17-14+