oxidanylidenemethylidene-[2-[2-(3-oxidanylpropanoyl)pyrrolidin-1-yl]pyrrolidin-1-yl]carbonyl-(phenylmethyl)azanium

Systemtic Name: oxidanylidenemethylidene-[2-[2-(3-oxidanylpropanoyl)pyrrolidin-1-yl]pyrrolidin-1-yl]carbonyl-(phenylmethyl)azanium Openeye Name: benzyl-[2-[2-(3-hydroxypropanoyl)pyrrolidin-1-yl]pyrrolidine-1-carbonyl]-(oxomethylene)ammonium CAS Name: [[2-[2-(3-hydroxy-1-oxopropyl)-1-pyrrolidinyl]-1-pyrrolidinyl]-oxomethyl]-(oxomethylidene)-(phenylmethyl)ammonium IUPAC Name: benzyl-[2-[2-(3-hydroxypropanoyl)pyrrolidin-1-yl]pyrrolidine-1-carbonyl]-(oxomethylidene)azanium Traditional Name: benzyl-[2-[2-(3-hydroxypropanoyl)pyrrolidino]pyrrolidine-1-carbonyl]-(ketomethylene)ammonium Formula: C20H26N3O4+ MolecularWeight: 372.43814

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C2CCCN2C(=O)[N+](=C=O)CC3=CC=CC=C3)C(=O)CCO

Isomeric SMILES

C1CC(N(C1)C2CCCN2C(=O)[N+](=C=O)CC3=CC=CC=C3)C(=O)CCO

InChI

InChI=1S/C20H26N3O4/c24-13-10-18(26)17-8-4-11-22(17)19-9-5-12-23(19)20(27)21(15-25)14-16-6-2-1-3-7-16/h1-3,6-7,17,19,24H,4-5,8-14H2/q+1