sodium (2S)-3,3-dimethyl-6-(naphthalen-2-ylmethylcarbamoylamino)-7-oxidanylidene-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate

Systemtic Name: sodium (2S)-3,3-dimethyl-6-(naphthalen-2-ylmethylcarbamoylamino)-7-oxidanylidene-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate Openeye Name: sodium (2S)-3,3-dimethyl-6-(2-naphthylmethylcarbamoylamino)-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate CAS Name: sodium (2S)-3,3-dimethyl-6-[[(2-naphthalenylmethylamino)-oxomethyl]amino]-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate IUPAC Name: sodium (2S)-3,3-dimethyl-6-(naphthalen-2-ylmethylcarbamoylamino)-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate Traditional Name: sodium (2S)-7-keto-3,3-dimethyl-6-(2-naphthylmethylcarbamoylamino)-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate Formula: C20H20N3NaO4S MolecularWeight: 421.44527

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(N2C(S1)C(C2=O)NC(=O)NCC3=CC4=CC=CC=C4C=C3)C(=O)[O-])C.[Na+]

Isomeric SMILES

CC1([C@@H](N2C(S1)C(C2=O)NC(=O)NCC3=CC4=CC=CC=C4C=C3)C(=O)[O-])C.[Na+]

InChI

InChI=1S/C20H21N3O4S.Na/c1-20(2)15(18(25)26)23-16(24)14(17(23)28-20)22-19(27)21-10-11-7-8-12-5-3-4-6-13(12)9-11;/h3-9,14-15,17H,10H2,1-2H3,(H,25,26)(H2,21,22,27);/q;+1/p-1/t14?,15-,17?;/m0./s1