(9-butan-2-ylcarbazol-3-yl)methyl (E)-3-phenylprop-2-enoate

Systemtic Name: (9-butan-2-ylcarbazol-3-yl)methyl (E)-3-phenylprop-2-enoate Openeye Name: (9-sec-butylcarbazol-3-yl)methyl (E)-3-phenylprop-2-enoate CAS Name: (E)-3-phenyl-2-propenoic acid (9-butan-2-yl-3-carbazolyl)methyl ester IUPAC Name: (9-butan-2-ylcarbazol-3-yl)methyl (E)-3-phenylprop-2-enoate Traditional Name: (E)-3-phenylacrylic acid (9-sec-butylcarbazol-3-yl)methyl ester Formula: C26H25NO2 MolecularWeight: 383.4822

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)N1C2=C(C=C(C=C2)COC(=O)C=CC3=CC=CC=C3)C4=CC=CC=C41

Isomeric SMILES

CCC(C)N1C2=C(C=C(C=C2)COC(=O)/C=C/C3=CC=CC=C3)C4=CC=CC=C41

InChI

InChI=1S/C26H25NO2/c1-3-19(2)27-24-12-8-7-11-22(24)23-17-21(13-15-25(23)27)18-29-26(28)16-14-20-9-5-4-6-10-20/h4-17,19H,3,18H2,1-2H3/b16-14+