diethyl-[2-(4-methyl-5-phenylmethoxycarbonyl-1H-pyrrol-3-yl)ethyl]azanium

Systemtic Name: diethyl-[2-(4-methyl-5-phenylmethoxycarbonyl-1H-pyrrol-3-yl)ethyl]azanium Openeye Name: 2-(5-benzyloxycarbonyl-4-methyl-1H-pyrrol-3-yl)ethyl-diethyl-ammonium CAS Name: diethyl-[2-(4-methyl-5-phenylmethoxycarbonyl-1H-pyrrol-3-yl)ethyl]ammonium IUPAC Name: diethyl-[2-(4-methyl-5-phenylmethoxycarbonyl-1H-pyrrol-3-yl)ethyl]azanium Traditional Name: 2-(5-carbobenzoxy-4-methyl-1H-pyrrol-3-yl)ethyl-diethyl-ammonium Formula: C19H27N2O2+ MolecularWeight: 315.42988

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCC1=CNC(=C1C)C(=O)OCC2=CC=CC=C2

Isomeric SMILES

CC[NH+](CC)CCC1=CNC(=C1C)C(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C19H26N2O2/c1-4-21(5-2)12-11-17-13-20-18(15(17)3)19(22)23-14-16-9-7-6-8-10-16/h6-10,13,20H,4-5,11-12,14H2,1-3H3/p+1