(E)-2-cyano-3-[1-(2-dimethylaminoethyl)-2-methyl-indol-3-yl]-N-dodecyl-prop-2-enamide

Systemtic Name: (E)-2-cyano-3-[1-(2-dimethylaminoethyl)-2-methyl-indol-3-yl]-N-dodecyl-prop-2-enamide Openeye Name: (E)-2-cyano-3-[1-(2-dimethylaminoethyl)-2-methyl-indol-3-yl]-N-dodecyl-prop-2-enamide CAS Name: (E)-2-cyano-3-[1-(2-dimethylaminoethyl)-2-methyl-3-indolyl]-N-dodecyl-2-propenamide IUPAC Name: (E)-2-cyano-3-[1-(2-dimethylaminoethyl)-2-methylindol-3-yl]-N-dodecylprop-2-enamide Traditional Name: (E)-2-cyano-3-[1-(2-dimethylaminoethyl)-2-methyl-indol-3-yl]-N-lauryl-acrylamide Formula: C29H44N4O MolecularWeight: 464.68586

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCNC(=O)C(=CC1=C(N(C2=CC=CC=C21)CCN(C)C)C)C#N

Isomeric SMILES

CCCCCCCCCCCCNC(=O)/C(=C/C1=C(N(C2=CC=CC=C21)CCN(C)C)C)/C#N

InChI

InChI=1S/C29H44N4O/c1-5-6-7-8-9-10-11-12-13-16-19-31-29(34)25(23-30)22-27-24(2)33(21-20-32(3)4)28-18-15-14-17-26(27)28/h14-15,17-18,22H,5-13,16,19-21H2,1-4H3,(H,31,34)/b25-22+