ethyl (E)-7-(benzotriazol-1-yl)-7-[phenyl-(phenylmethyl)amino]hept-2-enoate

Systemtic Name: ethyl (E)-7-(benzotriazol-1-yl)-7-[phenyl-(phenylmethyl)amino]hept-2-enoate Openeye Name: ethyl (E)-7-(benzotriazol-1-yl)-7-(N-benzylanilino)hept-2-enoate CAS Name: (E)-7-(1-benzotriazolyl)-7-(N-(phenylmethyl)anilino)-2-heptenoic acid ethyl ester IUPAC Name: ethyl (E)-7-(benzotriazol-1-yl)-7-(N-benzylanilino)hept-2-enoate Traditional Name: (E)-7-(benzotriazol-1-yl)-7-(N-benzylanilino)hept-2-enoic acid ethyl ester Formula: C28H30N4O2 MolecularWeight: 454.5634

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C=CCCCC(N1C2=CC=CC=C2N=N1)N(CC3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CCOC(=O)/C=C/CCCC(N1C2=CC=CC=C2N=N1)N(CC3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C28H30N4O2/c1-2-34-28(33)21-11-5-10-20-27(32-26-19-13-12-18-25(26)29-30-32)31(24-16-8-4-9-17-24)22-23-14-6-3-7-15-23/h3-4,6-9,11-19,21,27H,2,5,10,20,22H2,1H3/b21-11+