[2-[2,5-dimethyl-1-(phenylmethyl)pyrrol-3-yl]-2-oxidanylidene-ethyl]-methyl-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)azanium

Systemtic Name: [2-[2,5-dimethyl-1-(phenylmethyl)pyrrol-3-yl]-2-oxidanylidene-ethyl]-methyl-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)azanium Openeye Name: [2-(1-benzyl-2,5-dimethyl-pyrrol-3-yl)-2-oxo-ethyl]-methyl-(2-oxo-2-pyrrolidin-1-yl-ethyl)ammonium CAS Name: [2-[2,5-dimethyl-1-(phenylmethyl)-3-pyrrolyl]-2-oxoethyl]-methyl-[2-oxo-2-(1-pyrrolidinyl)ethyl]ammonium IUPAC Name: [2-(1-benzyl-2,5-dimethylpyrrol-3-yl)-2-oxoethyl]-methyl-(2-oxo-2-pyrrolidin-1-ylethyl)azanium Traditional Name: [2-(1-benzyl-2,5-dimethyl-pyrrol-3-yl)-2-keto-ethyl]-(2-keto-2-pyrrolidino-ethyl)-methyl-ammonium Formula: C22H30N3O2+ MolecularWeight: 368.4925

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1CC2=CC=CC=C2)C)C(=O)C[NH+](C)CC(=O)N3CCCC3

Isomeric SMILES

CC1=CC(=C(N1CC2=CC=CC=C2)C)C(=O)C[NH+](C)CC(=O)N3CCCC3

InChI

InChI=1S/C22H29N3O2/c1-17-13-20(18(2)25(17)14-19-9-5-4-6-10-19)21(26)15-23(3)16-22(27)24-11-7-8-12-24/h4-6,9-10,13H,7-8,11-12,14-16H2,1-3H3/p+1