7-[2-[3-[(6-chloranylnaphthalen-2-yl)sulfonylamino]-2-oxidanylidene-pyrrolidin-1-yl]propanoyl]-3,7-diazabicyclo[3.3.1]nonane-3-carboxylate

Systemtic Name: 7-[2-[3-[(6-chloranylnaphthalen-2-yl)sulfonylamino]-2-oxidanylidene-pyrrolidin-1-yl]propanoyl]-3,7-diazabicyclo[3.3.1]nonane-3-carboxylate Openeye Name: 7-[2-[3-[(6-chloro-2-naphthyl)sulfonylamino]-2-oxo-pyrrolidin-1-yl]propanoyl]-3,7-diazabicyclo[3.3.1]nonane-3-carboxylate CAS Name: 7-[2-[3-[(6-chloro-2-naphthalenyl)sulfonylamino]-2-oxo-1-pyrrolidinyl]-1-oxopropyl]-3,7-diazabicyclo[3.3.1]nonane-3-carboxylate IUPAC Name: 7-[2-[3-[(6-chloronaphthalen-2-yl)sulfonylamino]-2-oxopyrrolidin-1-yl]propanoyl]-3,7-diazabicyclo[3.3.1]nonane-3-carboxylate Traditional Name: 7-[2-[3-[(6-chloro-2-naphthyl)sulfonylamino]-2-keto-pyrrolidino]propanoyl]-3,7-diazabicyclo[3.3.1]nonane-3-carboxylate Formula: C25H28ClN4O6S- MolecularWeight: 548.03102

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CC2CC(C1)CN(C2)C(=O)[O-])N3CCC(C3=O)NS(=O)(=O)C4=CC5=C(C=C4)C=C(C=C5)Cl

Isomeric SMILES

CC(C(=O)N1CC2CC(C1)CN(C2)C(=O)[O-])N3CCC(C3=O)NS(=O)(=O)C4=CC5=C(C=C4)C=C(C=C5)Cl

InChI

InChI=1S/C25H29ClN4O6S/c1-15(23(31)28-11-16-8-17(12-28)14-29(13-16)25(33)34)30-7-6-22(24(30)32)27-37(35,36)21-5-3-18-9-20(26)4-2-19(18)10-21/h2-5,9-10,15-17,22,27H,6-8,11-14H2,1H3,(H,33,34)/p-1