7-methoxy-3-methyl-7-[(3-methyl-2-phenyl-but-3-enoyl)amino]-8-oxidanylidene-5-oxa-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid

Systemtic Name: 7-methoxy-3-methyl-7-[(3-methyl-2-phenyl-but-3-enoyl)amino]-8-oxidanylidene-5-oxa-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Openeye Name: 7-methoxy-3-methyl-7-[(3-methyl-2-phenyl-but-3-enoyl)amino]-8-oxo-5-oxa-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid CAS Name: 7-methoxy-3-methyl-7-[(3-methyl-1-oxo-2-phenylbut-3-enyl)amino]-8-oxo-5-oxa-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid IUPAC Name: 7-methoxy-3-methyl-7-[(3-methyl-2-phenylbut-3-enoyl)amino]-8-oxo-5-oxa-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Traditional Name: 8-keto-7-methoxy-3-methyl-7-[(3-methyl-2-phenyl-but-3-enoyl)amino]-5-oxa-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Formula: C20H22N2O6 MolecularWeight: 386.39848

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N2C(C(C2=O)(NC(=O)C(C3=CC=CC=C3)C(=C)C)OC)OC1)C(=O)O

Isomeric SMILES

CC1=C(N2C(C(C2=O)(NC(=O)C(C3=CC=CC=C3)C(=C)C)OC)OC1)C(=O)O

InChI

InChI=1S/C20H22N2O6/c1-11(2)14(13-8-6-5-7-9-13)16(23)21-20(27-4)18(26)22-15(17(24)25)12(3)10-28-19(20)22/h5-9,14,19H,1,10H2,2-4H3,(H,21,23)(H,24,25)