2-[(5-ethoxycarbonyl-2,4-dimethyl-1H-pyrrol-3-yl)carbonylamino]ethyl-di(propan-2-yl)azanium

Systemtic Name: 2-[(5-ethoxycarbonyl-2,4-dimethyl-1H-pyrrol-3-yl)carbonylamino]ethyl-di(propan-2-yl)azanium Openeye Name: 2-[(5-ethoxycarbonyl-2,4-dimethyl-1H-pyrrole-3-carbonyl)amino]ethyl-diisopropyl-ammonium CAS Name: 2-[[(5-ethoxycarbonyl-2,4-dimethyl-1H-pyrrol-3-yl)-oxomethyl]amino]ethyl-di(propan-2-yl)ammonium IUPAC Name: 2-[(5-ethoxycarbonyl-2,4-dimethyl-1H-pyrrole-3-carbonyl)amino]ethyl-di(propan-2-yl)azanium Traditional Name: 2-[(5-carbethoxy-2,4-dimethyl-1H-pyrrole-3-carbonyl)amino]ethyl-diisopropyl-ammonium Formula: C18H32N3O3+ MolecularWeight: 338.46498

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C(N1)C)C(=O)NCC[NH+](C(C)C)C(C)C)C

Isomeric SMILES

CCOC(=O)C1=C(C(=C(N1)C)C(=O)NCC[NH+](C(C)C)C(C)C)C

InChI

InChI=1S/C18H31N3O3/c1-8-24-18(23)16-13(6)15(14(7)20-16)17(22)19-9-10-21(11(2)3)12(4)5/h11-12,20H,8-10H2,1-7H3,(H,19,22)/p+1