sodium; N-[3-(hydroxymethyl)phenyl]methanamide; 2-oxidanylidene-4-[(1-oxidanylidene-1-phenylmethoxy-propan-2-yl)carbamoyl]azetidine-1-sulfonate

Systemtic Name: sodium; N-[3-(hydroxymethyl)phenyl]methanamide; 2-oxidanylidene-4-[(1-oxidanylidene-1-phenylmethoxy-propan-2-yl)carbamoyl]azetidine-1-sulfonate Openeye Name: sodium; 2-[(2-benzyloxy-1-methyl-2-oxo-ethyl)carbamoyl]-4-oxo-azetidine-1-sulfonate; N-[3-(hydroxymethyl)phenyl]formamide CAS Name: sodium; N-[3-(hydroxymethyl)phenyl]formamide; 2-oxo-4-[oxo-[(1-oxo-1-phenylmethoxypropan-2-yl)amino]methyl]-1-azetidinesulfonate IUPAC Name: sodium; N-[3-(hydroxymethyl)phenyl]formamide; 2-oxo-4-[(1-oxo-1-phenylmethoxypropan-2-yl)carbamoyl]azetidine-1-sulfonate Traditional Name: sodium; 2-[(2-benzoxy-2-keto-1-methyl-ethyl)carbamoyl]-4-keto-azetidine-1-sulfonate; N-(3-methylolphenyl)formamide Formula: C22H24N3NaO9S MolecularWeight: 529.49543

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OCC1=CC=CC=C1)NC(=O)C2CC(=O)N2S(=O)(=O)[O-].C1=CC(=CC(=C1)NC=O)CO.[Na+]

Isomeric SMILES

CC(C(=O)OCC1=CC=CC=C1)NC(=O)C2CC(=O)N2S(=O)(=O)[O-].C1=CC(=CC(=C1)NC=O)CO.[Na+]

InChI

InChI=1S/C14H16N2O7S.C8H9NO2.Na/c1-9(14(19)23-8-10-5-3-2-4-6-10)15-13(18)11-7-12(17)16(11)24(20,21)22;10-5-7-2-1-3-8(4-7)9-6-11;/h2-6,9,11H,7-8H2,1H3,(H,15,18)(H,20,21,22);1-4,6,10H,5H2,(H,9,11);/q;;+1/p-1