7-[3-(cyclopentylideneamino)oxypropanoylamino]-3-methyl-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid

Systemtic Name: 7-[3-(cyclopentylideneamino)oxypropanoylamino]-3-methyl-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Openeye Name: 7-[3-(cyclopentylideneamino)oxypropanoylamino]-3-methyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid CAS Name: 7-[[3-(cyclopentylideneamino)oxy-1-oxopropyl]amino]-3-methyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid IUPAC Name: 7-[3-(cyclopentylideneamino)oxypropanoylamino]-3-methyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Traditional Name: 7-[3-(cyclopentylideneamino)oxypropanoylamino]-8-keto-3-methyl-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Formula: C16H21N3O5S MolecularWeight: 367.42004

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N2C(C(C2=O)NC(=O)CCON=C3CCCC3)SC1)C(=O)O

Isomeric SMILES

CC1=C(N2C(C(C2=O)NC(=O)CCON=C3CCCC3)SC1)C(=O)O

InChI

InChI=1S/C16H21N3O5S/c1-9-8-25-15-12(14(21)19(15)13(9)16(22)23)17-11(20)6-7-24-18-10-4-2-3-5-10/h12,15H,2-8H2,1H3,(H,17,20)(H,22,23)