[(1S)-2-[(4-ethanoyl-1H-pyrrol-2-yl)carbonylamino]-1-(4-methoxyphenyl)ethyl]-dimethyl-azanium

Systemtic Name: [(1S)-2-[(4-ethanoyl-1H-pyrrol-2-yl)carbonylamino]-1-(4-methoxyphenyl)ethyl]-dimethyl-azanium Openeye Name: [(1S)-2-[(4-acetyl-1H-pyrrole-2-carbonyl)amino]-1-(4-methoxyphenyl)ethyl]-dimethyl-ammonium CAS Name: [(1S)-2-[[(4-acetyl-1H-pyrrol-2-yl)-oxomethyl]amino]-1-(4-methoxyphenyl)ethyl]-dimethylammonium IUPAC Name: [(1S)-2-[(4-acetyl-1H-pyrrole-2-carbonyl)amino]-1-(4-methoxyphenyl)ethyl]-dimethylazanium Traditional Name: [(1S)-2-[(4-acetyl-1H-pyrrole-2-carbonyl)amino]-1-(4-methoxyphenyl)ethyl]-dimethyl-ammonium Formula: C18H24N3O3+ MolecularWeight: 330.40146

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H23N3O3/c1-12(22)14-9-16(19-10-14)18(23)20-11-17(21(2)3)13-5-7-15(24-4)8-6-13/h5-10,17,19H,11H2,1-4H3,(H,20,23)/p+1/t17-/m1/s1