(E)-5-[1H-indol-2-ylmethyl-(phenylmethyl)amino]pent-3-en-2-one

Systemtic Name: (E)-5-[1H-indol-2-ylmethyl-(phenylmethyl)amino]pent-3-en-2-one Openeye Name: (E)-5-[benzyl(1H-indol-2-ylmethyl)amino]pent-3-en-2-one CAS Name: (E)-5-[1H-indol-2-ylmethyl-(phenylmethyl)amino]-3-penten-2-one IUPAC Name: (E)-5-[benzyl(1H-indol-2-ylmethyl)amino]pent-3-en-2-one Traditional Name: (E)-5-[benzyl(1H-indol-2-ylmethyl)amino]pent-3-en-2-one Formula: C21H22N2O MolecularWeight: 318.41218

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C=CCN(CC1=CC=CC=C1)CC2=CC3=CC=CC=C3N2

Isomeric SMILES

CC(=O)/C=C/CN(CC1=CC=CC=C1)CC2=CC3=CC=CC=C3N2

InChI

InChI=1S/C21H22N2O/c1-17(24)8-7-13-23(15-18-9-3-2-4-10-18)16-20-14-19-11-5-6-12-21(19)22-20/h2-12,14,22H,13,15-16H2,1H3/b8-7+