[(1S)-2-[(4-ethanoyl-3,5-dimethyl-1H-pyrrol-2-yl)carbonylamino]-1-phenyl-ethyl]-diethyl-azanium

Systemtic Name: [(1S)-2-[(4-ethanoyl-3,5-dimethyl-1H-pyrrol-2-yl)carbonylamino]-1-phenyl-ethyl]-diethyl-azanium Openeye Name: [(1S)-2-[(4-acetyl-3,5-dimethyl-1H-pyrrole-2-carbonyl)amino]-1-phenyl-ethyl]-diethyl-ammonium CAS Name: [(1S)-2-[[(4-acetyl-3,5-dimethyl-1H-pyrrol-2-yl)-oxomethyl]amino]-1-phenylethyl]-diethylammonium IUPAC Name: [(1S)-2-[(4-acetyl-3,5-dimethyl-1H-pyrrole-2-carbonyl)amino]-1-phenylethyl]-diethylazanium Traditional Name: [(1S)-2-[(4-acetyl-3,5-dimethyl-1H-pyrrole-2-carbonyl)amino]-1-phenyl-ethyl]-diethyl-ammonium Formula: C21H30N3O2+ MolecularWeight: 356.4818

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)C(CNC(=O)C1=C(C(=C(N1)C)C(=O)C)C)C2=CC=CC=C2

Isomeric SMILES

CC[NH+](CC)[C@H](CNC(=O)C1=C(C(=C(N1)C)C(=O)C)C)C2=CC=CC=C2

InChI

InChI=1S/C21H29N3O2/c1-6-24(7-2)18(17-11-9-8-10-12-17)13-22-21(26)20-14(3)19(16(5)25)15(4)23-20/h8-12,18,23H,6-7,13H2,1-5H3,(H,22,26)/p+1/t18-/m1/s1