[3-[[(Z)-2-benzamido-3-(1H-pyrrol-2-yl)prop-2-enoyl]amino]-2,2-dimethyl-propyl]-dimethyl-azanium

Systemtic Name: [3-[[(Z)-2-benzamido-3-(1H-pyrrol-2-yl)prop-2-enoyl]amino]-2,2-dimethyl-propyl]-dimethyl-azanium Openeye Name: [3-[[(Z)-2-benzamido-3-(1H-pyrrol-2-yl)prop-2-enoyl]amino]-2,2-dimethyl-propyl]-dimethyl-ammonium CAS Name: [3-[[(Z)-2-benzamido-1-oxo-3-(1H-pyrrol-2-yl)prop-2-enyl]amino]-2,2-dimethylpropyl]-dimethylammonium IUPAC Name: [3-[[(Z)-2-benzamido-3-(1H-pyrrol-2-yl)prop-2-enoyl]amino]-2,2-dimethylpropyl]-dimethylazanium Traditional Name: [3-[[(Z)-2-benzamido-3-(1H-pyrrol-2-yl)acryloyl]amino]-2,2-dimethyl-propyl]-dimethyl-ammonium Formula: C21H29N4O2+ MolecularWeight: 369.48056

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CNC(=O)C(=CC1=CC=CN1)NC(=O)C2=CC=CC=C2)C[NH+](C)C

Isomeric SMILES

CC(C)(CNC(=O)/C(=C/C1=CC=CN1)/NC(=O)C2=CC=CC=C2)C[NH+](C)C

InChI

InChI=1S/C21H28N4O2/c1-21(2,15-25(3)4)14-23-20(27)18(13-17-11-8-12-22-17)24-19(26)16-9-6-5-7-10-16/h5-13,22H,14-15H2,1-4H3,(H,23,27)(H,24,26)/p+1/b18-13-