(2-acetamido-3-ethoxy-2-ethoxycarbonyl-3-oxidanylidene-propyl)-methyl-(phenylmethyl)azanium

Systemtic Name: (2-acetamido-3-ethoxy-2-ethoxycarbonyl-3-oxidanylidene-propyl)-methyl-(phenylmethyl)azanium Openeye Name: (2-acetamido-3-ethoxy-2-ethoxycarbonyl-3-oxo-propyl)-benzyl-methyl-ammonium CAS Name: (2-acetamido-3-ethoxy-2-ethoxycarbonyl-3-oxopropyl)-methyl-(phenylmethyl)ammonium IUPAC Name: (2-acetamido-3-ethoxy-2-ethoxycarbonyl-3-oxopropyl)-benzyl-methylazanium Traditional Name: (2-acetamido-2-carbethoxy-3-ethoxy-3-keto-propyl)-benzyl-methyl-ammonium Formula: C18H27N2O5+ MolecularWeight: 351.41738

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C[NH+](C)CC1=CC=CC=C1)(C(=O)OCC)NC(=O)C

Isomeric SMILES

CCOC(=O)C(C[NH+](C)CC1=CC=CC=C1)(C(=O)OCC)NC(=O)C

InChI

InChI=1S/C18H26N2O5/c1-5-24-16(22)18(19-14(3)21,17(23)25-6-2)13-20(4)12-15-10-8-7-9-11-15/h7-11H,5-6,12-13H2,1-4H3,(H,19,21)/p+1