1,5-dimethyl-2-phenyl-pyrazol-3-one; ethyl 4-azanylbenzoate

Systemtic Name: 1,5-dimethyl-2-phenyl-pyrazol-3-one; ethyl 4-azanylbenzoate Openeye Name: 1,5-dimethyl-2-phenyl-pyrazol-3-one; ethyl 4-aminobenzoate CAS Name: 4-aminobenzoic acid ethyl ester; 1,5-dimethyl-2-phenyl-3-pyrazolone IUPAC Name: 1,5-dimethyl-2-phenylpyrazol-3-one; ethyl 4-aminobenzoate Traditional Name: 4-aminobenzoic acid ethyl ester; antipyrine Formula: C20H23N3O3 MolecularWeight: 353.41492

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)N.CC1=CC(=O)N(N1C)C2=CC=CC=C2

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)N.CC1=CC(=O)N(N1C)C2=CC=CC=C2

InChI

InChI=1S/C11H12N2O.C9H11NO2/c1-9-8-11(14)13(12(9)2)10-6-4-3-5-7-10;1-2-12-9(11)7-3-5-8(10)6-4-7/h3-8H,1-2H3;3-6H,2,10H2,1H3