3-(methylaminomethyl)-7-oxidanylidene-6-prop-2-enyl-6-pyrrolidin-3-ylsulfanyl-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid

Systemtic Name: 3-(methylaminomethyl)-7-oxidanylidene-6-prop-2-enyl-6-pyrrolidin-3-ylsulfanyl-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid Openeye Name: 6-allyl-3-(methylaminomethyl)-7-oxo-6-pyrrolidin-3-ylsulfanyl-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid CAS Name: 3-(methylaminomethyl)-7-oxo-6-prop-2-enyl-6-(3-pyrrolidinylthio)-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid IUPAC Name: 3-(methylaminomethyl)-7-oxo-6-prop-2-enyl-6-pyrrolidin-3-ylsulfanyl-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid Traditional Name: 6-allyl-7-keto-3-(methylaminomethyl)-6-(pyrrolidin-3-ylthio)-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid Formula: C16H23N3O3S MolecularWeight: 337.43712

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Descriptors Computed from Structure

Canonical SMILES:

CNCC1=C(N2C(C1)C(C2=O)(CC=C)SC3CCNC3)C(=O)O

Isomeric SMILES

CNCC1=C(N2C(C1)C(C2=O)(CC=C)SC3CCNC3)C(=O)O

InChI

InChI=1S/C16H23N3O3S/c1-3-5-16(23-11-4-6-18-9-11)12-7-10(8-17-2)13(14(20)21)19(12)15(16)22/h3,11-12,17-18H,1,4-9H2,2H3,(H,20,21)