tert-butyl (E,2Z)-4-[phenylcarbonyl-(phenylmethyl)amino]-2-(phenylmethylidene)but-3-enoate

Systemtic Name: tert-butyl (E,2Z)-4-[phenylcarbonyl-(phenylmethyl)amino]-2-(phenylmethylidene)but-3-enoate Openeye Name: tert-butyl (E,2Z)-4-[benzoyl(benzyl)amino]-2-benzylidene-but-3-enoate CAS Name: (E,2Z)-4-[benzoyl-(phenylmethyl)amino]-2-(phenylmethylene)-3-butenoic acid tert-butyl ester IUPAC Name: tert-butyl (E,2Z)-4-[benzoyl(benzyl)amino]-2-benzylidenebut-3-enoate Traditional Name: (E,2Z)-2-benzal-4-[benzoyl(benzyl)amino]but-3-enoic acid tert-butyl ester Formula: C29H29NO3 MolecularWeight: 439.54546

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C(=CC1=CC=CC=C1)C=CN(CC2=CC=CC=C2)C(=O)C3=CC=CC=C3

Isomeric SMILES

CC(C)(C)OC(=O)/C(=C\C1=CC=CC=C1)/C=C/N(CC2=CC=CC=C2)C(=O)C3=CC=CC=C3

InChI

InChI=1S/C29H29NO3/c1-29(2,3)33-28(32)26(21-23-13-7-4-8-14-23)19-20-30(22-24-15-9-5-10-16-24)27(31)25-17-11-6-12-18-25/h4-21H,22H2,1-3H3/b20-19+,26-21-