(2-azanyl-3-phenyl-phenyl) (Z)-2-methyl-4-(1-methylpyrazol-4-yl)but-2-enoate

Systemtic Name: (2-azanyl-3-phenyl-phenyl) (Z)-2-methyl-4-(1-methylpyrazol-4-yl)but-2-enoate Openeye Name: (2-amino-3-phenyl-phenyl) (Z)-2-methyl-4-(1-methylpyrazol-4-yl)but-2-enoate CAS Name: (Z)-2-methyl-4-(1-methyl-4-pyrazolyl)-2-butenoic acid (2-amino-3-phenylphenyl) ester IUPAC Name: (2-amino-3-phenylphenyl) (Z)-2-methyl-4-(1-methylpyrazol-4-yl)but-2-enoate Traditional Name: (Z)-2-methyl-4-(1-methylpyrazol-4-yl)but-2-enoic acid (2-amino-3-phenyl-phenyl) ester Formula: C21H21N3O2 MolecularWeight: 347.41034

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=CCC1=CN(N=C1)C)C(=O)OC2=CC=CC(=C2N)C3=CC=CC=C3

Isomeric SMILES

C/C(=C/CC1=CN(N=C1)C)/C(=O)OC2=CC=CC(=C2N)C3=CC=CC=C3

InChI

InChI=1S/C21H21N3O2/c1-15(11-12-16-13-23-24(2)14-16)21(25)26-19-10-6-9-18(20(19)22)17-7-4-3-5-8-17/h3-11,13-14H,12,22H2,1-2H3/b15-11-