2-[[(E)-2-benzamido-3-(1-methylpyrrol-2-yl)prop-2-enoyl]amino]ethyl-dimethyl-azanium

Systemtic Name: 2-[[(E)-2-benzamido-3-(1-methylpyrrol-2-yl)prop-2-enoyl]amino]ethyl-dimethyl-azanium Openeye Name: 2-[[(E)-2-benzamido-3-(1-methylpyrrol-2-yl)prop-2-enoyl]amino]ethyl-dimethyl-ammonium CAS Name: 2-[[(E)-2-benzamido-3-(1-methyl-2-pyrrolyl)-1-oxoprop-2-enyl]amino]ethyl-dimethylammonium IUPAC Name: 2-[[(E)-2-benzamido-3-(1-methylpyrrol-2-yl)prop-2-enoyl]amino]ethyl-dimethylazanium Traditional Name: 2-[[(E)-2-benzamido-3-(1-methylpyrrol-2-yl)acryloyl]amino]ethyl-dimethyl-ammonium Formula: C19H25N4O2+ MolecularWeight: 341.4274

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC=C1C=C(C(=O)NCC[NH+](C)C)NC(=O)C2=CC=CC=C2

Isomeric SMILES

CN1C=CC=C1/C=C(\C(=O)NCC[NH+](C)C)/NC(=O)C2=CC=CC=C2

InChI

InChI=1S/C19H24N4O2/c1-22(2)13-11-20-19(25)17(14-16-10-7-12-23(16)3)21-18(24)15-8-5-4-6-9-15/h4-10,12,14H,11,13H2,1-3H3,(H,20,25)(H,21,24)/p+1/b17-14+