tert-butyl N-[4-[5-[(E)-2-phenylethenyl]-1H-pyrazol-3-yl]phenyl]carbamate

Systemtic Name: tert-butyl N-[4-[5-[(E)-2-phenylethenyl]-1H-pyrazol-3-yl]phenyl]carbamate Openeye Name: tert-butyl N-[4-[5-[(E)-styryl]-1H-pyrazol-3-yl]phenyl]carbamate CAS Name: N-[4-[5-[(E)-2-phenylethenyl]-1H-pyrazol-3-yl]phenyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[4-[5-[(E)-2-phenylethenyl]-1H-pyrazol-3-yl]phenyl]carbamate Traditional Name: N-[4-[5-[(E)-styryl]-1H-pyrazol-3-yl]phenyl]carbamic acid tert-butyl ester Formula: C22H23N3O2 MolecularWeight: 361.43692

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC1=CC=C(C=C1)C2=NNC(=C2)C=CC3=CC=CC=C3

Isomeric SMILES

CC(C)(C)OC(=O)NC1=CC=C(C=C1)C2=NNC(=C2)/C=C/C3=CC=CC=C3

InChI

InChI=1S/C22H23N3O2/c1-22(2,3)27-21(26)23-18-13-10-17(11-14-18)20-15-19(24-25-20)12-9-16-7-5-4-6-8-16/h4-15H,1-3H3,(H,23,26)(H,24,25)/b12-9+