1-[1-(4-ethoxyphenyl)-2,5-dimethyl-pyrrol-3-yl]-2-morpholin-4-ium-4-yl-ethanone

Systemtic Name: 1-[1-(4-ethoxyphenyl)-2,5-dimethyl-pyrrol-3-yl]-2-morpholin-4-ium-4-yl-ethanone Openeye Name: 1-[1-(4-ethoxyphenyl)-2,5-dimethyl-pyrrol-3-yl]-2-morpholin-4-ium-4-yl-ethanone CAS Name: 1-[1-(4-ethoxyphenyl)-2,5-dimethyl-3-pyrrolyl]-2-(4-morpholin-4-iumyl)ethanone IUPAC Name: 1-[1-(4-ethoxyphenyl)-2,5-dimethylpyrrol-3-yl]-2-morpholin-4-ium-4-ylethanone Traditional Name: 1-(2,5-dimethyl-1-p-phenetyl-pyrrol-3-yl)-2-morpholin-4-ium-4-yl-ethanone Formula: C20H27N2O3+ MolecularWeight: 343.43998

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)N2C(=CC(=C2C)C(=O)C[NH+]3CCOCC3)C

Isomeric SMILES

CCOC1=CC=C(C=C1)N2C(=CC(=C2C)C(=O)C[NH+]3CCOCC3)C

InChI

InChI=1S/C20H26N2O3/c1-4-25-18-7-5-17(6-8-18)22-15(2)13-19(16(22)3)20(23)14-21-9-11-24-12-10-21/h5-8,13H,4,9-12,14H2,1-3H3/p+1