N-[2-(1H-indol-3-yl)ethyl]-4-[[[(E)-2-methyl-3-phenyl-prop-2-enoyl]amino]methyl]benzamide

Systemtic Name: N-[2-(1H-indol-3-yl)ethyl]-4-[[[(E)-2-methyl-3-phenyl-prop-2-enoyl]amino]methyl]benzamide Openeye Name: N-[2-(1H-indol-3-yl)ethyl]-4-[[[(E)-2-methyl-3-phenyl-prop-2-enoyl]amino]methyl]benzamide CAS Name: N-[2-(1H-indol-3-yl)ethyl]-4-[[[(E)-2-methyl-1-oxo-3-phenylprop-2-enyl]amino]methyl]benzamide IUPAC Name: N-[2-(1H-indol-3-yl)ethyl]-4-[[[(E)-2-methyl-3-phenylprop-2-enoyl]amino]methyl]benzamide Traditional Name: N-[2-(1H-indol-3-yl)ethyl]-4-[[[(E)-2-methyl-3-phenyl-acryloyl]amino]methyl]benzamide Formula: C28H27N3O2 MolecularWeight: 437.53288

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC1=CC=CC=C1)C(=O)NCC2=CC=C(C=C2)C(=O)NCCC3=CNC4=CC=CC=C43

Isomeric SMILES

C/C(=C\C1=CC=CC=C1)/C(=O)NCC2=CC=C(C=C2)C(=O)NCCC3=CNC4=CC=CC=C43

InChI

InChI=1S/C28H27N3O2/c1-20(17-21-7-3-2-4-8-21)27(32)31-18-22-11-13-23(14-12-22)28(33)29-16-15-24-19-30-26-10-6-5-9-25(24)26/h2-14,17,19,30H,15-16,18H2,1H3,(H,29,33)(H,31,32)/b20-17+