[2,6-dimethyl-4-[(1-phenylpyrazol-3-yl)amino]phenyl] 4-(dimethylamino)butanoate

Systemtic Name: [2,6-dimethyl-4-[(1-phenylpyrazol-3-yl)amino]phenyl] 4-(dimethylamino)butanoate Openeye Name: [2,6-dimethyl-4-[(1-phenylpyrazol-3-yl)amino]phenyl] 4-(dimethylamino)butanoate CAS Name: 4-(dimethylamino)butanoic acid [2,6-dimethyl-4-[(1-phenyl-3-pyrazolyl)amino]phenyl] ester IUPAC Name: [2,6-dimethyl-4-[(1-phenylpyrazol-3-yl)amino]phenyl] 4-(dimethylamino)butanoate Traditional Name: 4-(dimethylamino)butyric acid [2,6-dimethyl-4-[(1-phenylpyrazol-3-yl)amino]phenyl] ester Formula: C23H28N4O2 MolecularWeight: 392.49402

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1OC(=O)CCCN(C)C)C)NC2=NN(C=C2)C3=CC=CC=C3

Isomeric SMILES

CC1=CC(=CC(=C1OC(=O)CCCN(C)C)C)NC2=NN(C=C2)C3=CC=CC=C3

InChI

InChI=1S/C23H28N4O2/c1-17-15-19(16-18(2)23(17)29-22(28)11-8-13-26(3)4)24-21-12-14-27(25-21)20-9-6-5-7-10-20/h5-7,9-10,12,14-16H,8,11,13H2,1-4H3,(H,24,25)