3,3-dimethyl-7-oxidanylidene-6-[(triphenylmethyl)amino]-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate; triethylazanium

Systemtic Name: 3,3-dimethyl-7-oxidanylidene-6-[(triphenylmethyl)amino]-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate; triethylazanium Openeye Name: 3,3-dimethyl-7-oxo-6-(tritylamino)-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate; triethylammonium CAS Name: 3,3-dimethyl-7-oxo-6-[(triphenylmethyl)amino]-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate; triethylammonium IUPAC Name: 3,3-dimethyl-7-oxo-6-(tritylamino)-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate; triethylazanium Traditional Name: 7-keto-3,3-dimethyl-6-(tritylamino)-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate; triethylammonium Formula: C33H41N3O3S MolecularWeight: 559.76194

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CC.CC1(C(N2C(S1)C(C2=O)NC(C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5)C(=O)[O-])C

Isomeric SMILES

CC[NH+](CC)CC.CC1(C(N2C(S1)C(C2=O)NC(C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5)C(=O)[O-])C

InChI

InChI=1S/C27H26N2O3S.C6H15N/c1-26(2)22(25(31)32)29-23(30)21(24(29)33-26)28-27(18-12-6-3-7-13-18,19-14-8-4-9-15-19)20-16-10-5-11-17-20;1-4-7(5-2)6-3/h3-17,21-22,24,28H,1-2H3,(H,31,32);4-6H2,1-3H3