4-[(4-dimethylaminophenyl)methylcarbamoyl]-6-oxidanylidene-4,7-diazabicyclo[3.2.0]heptane-7-sulfonic acid

Systemtic Name: 4-[(4-dimethylaminophenyl)methylcarbamoyl]-6-oxidanylidene-4,7-diazabicyclo[3.2.0]heptane-7-sulfonic acid Openeye Name: 4-[(4-dimethylaminophenyl)methylcarbamoyl]-6-oxo-4,7-diazabicyclo[3.2.0]heptane-7-sulfonic acid CAS Name: 4-[[(4-dimethylaminophenyl)methylamino]-oxomethyl]-6-oxo-4,7-diazabicyclo[3.2.0]heptane-7-sulfonic acid IUPAC Name: 4-[(4-dimethylaminophenyl)methylcarbamoyl]-6-oxo-4,7-diazabicyclo[3.2.0]heptane-7-sulfonic acid Traditional Name: 4-[[4-(dimethylamino)benzyl]carbamoyl]-6-keto-4,7-diazabicyclo[3.2.0]heptane-7-sulfonic acid Formula: C15H20N4O5S MolecularWeight: 368.4081

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)CNC(=O)N2CCC3C2C(=O)N3S(=O)(=O)O

Isomeric SMILES

CN(C)C1=CC=C(C=C1)CNC(=O)N2CCC3C2C(=O)N3S(=O)(=O)O

InChI

InChI=1S/C15H20N4O5S/c1-17(2)11-5-3-10(4-6-11)9-16-15(21)18-8-7-12-13(18)14(20)19(12)25(22,23)24/h3-6,12-13H,7-9H2,1-2H3,(H,16,21)(H,22,23,24)