(E)-4-[(1,3-diphenylpyrazol-4-yl)methyl-methyl-amino]-4-oxidanylidene-but-2-enoate

Systemtic Name: (E)-4-[(1,3-diphenylpyrazol-4-yl)methyl-methyl-amino]-4-oxidanylidene-but-2-enoate Openeye Name: (E)-4-[(1,3-diphenylpyrazol-4-yl)methyl-methyl-amino]-4-oxo-but-2-enoate CAS Name: (E)-4-[(1,3-diphenyl-4-pyrazolyl)methyl-methylamino]-4-oxo-2-butenoate IUPAC Name: (E)-4-[(1,3-diphenylpyrazol-4-yl)methyl-methylamino]-4-oxobut-2-enoate Traditional Name: (E)-4-[(1,3-diphenylpyrazol-4-yl)methyl-methyl-amino]-4-keto-but-2-enoate Formula: C21H18N3O3- MolecularWeight: 360.38592

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CN(N=C1C2=CC=CC=C2)C3=CC=CC=C3)C(=O)C=CC(=O)[O-]

Isomeric SMILES

CN(CC1=CN(N=C1C2=CC=CC=C2)C3=CC=CC=C3)C(=O)/C=C/C(=O)[O-]

InChI

InChI=1S/C21H19N3O3/c1-23(19(25)12-13-20(26)27)14-17-15-24(18-10-6-3-7-11-18)22-21(17)16-8-4-2-5-9-16/h2-13,15H,14H2,1H3,(H,26,27)/p-1/b13-12+