methyl-[(2-methylphenyl)methyl]-[2-oxidanylidene-2-(5-pyrrolidin-1-ylcarbonyl-1H-pyrrol-3-yl)ethyl]azanium

Systemtic Name: methyl-[(2-methylphenyl)methyl]-[2-oxidanylidene-2-(5-pyrrolidin-1-ylcarbonyl-1H-pyrrol-3-yl)ethyl]azanium Openeye Name: methyl-(o-tolylmethyl)-[2-oxo-2-[5-(pyrrolidine-1-carbonyl)-1H-pyrrol-3-yl]ethyl]ammonium CAS Name: methyl-[(2-methylphenyl)methyl]-[2-oxo-2-[5-[oxo(1-pyrrolidinyl)methyl]-1H-pyrrol-3-yl]ethyl]ammonium IUPAC Name: methyl-[(2-methylphenyl)methyl]-[2-oxo-2-[5-(pyrrolidine-1-carbonyl)-1H-pyrrol-3-yl]ethyl]azanium Traditional Name: [2-keto-2-[5-(pyrrolidine-1-carbonyl)-1H-pyrrol-3-yl]ethyl]-methyl-(2-methylbenzyl)ammonium Formula: C20H26N3O2+ MolecularWeight: 340.43934

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C[NH+](C)CC(=O)C2=CNC(=C2)C(=O)N3CCCC3

Isomeric SMILES

CC1=CC=CC=C1C[NH+](C)CC(=O)C2=CNC(=C2)C(=O)N3CCCC3

InChI

InChI=1S/C20H25N3O2/c1-15-7-3-4-8-16(15)13-22(2)14-19(24)17-11-18(21-12-17)20(25)23-9-5-6-10-23/h3-4,7-8,11-12,21H,5-6,9-10,13-14H2,1-2H3/p+1