methyl (6S)-8-[(E)-3-(4-chlorophenyl)-3-oxidanylidene-prop-1-enyl]-2-oxidanylidene-8-azabicyclo[3.2.1]oct-3-ene-6-carboxylate

Systemtic Name: methyl (6S)-8-[(E)-3-(4-chlorophenyl)-3-oxidanylidene-prop-1-enyl]-2-oxidanylidene-8-azabicyclo[3.2.1]oct-3-ene-6-carboxylate Openeye Name: methyl (6S)-8-[(E)-3-(4-chlorophenyl)-3-oxo-prop-1-enyl]-2-oxo-8-azabicyclo[3.2.1]oct-3-ene-6-carboxylate CAS Name: (6S)-8-[(E)-3-(4-chlorophenyl)-3-oxoprop-1-enyl]-2-oxo-8-azabicyclo[3.2.1]oct-3-ene-6-carboxylic acid methyl ester IUPAC Name: methyl (6S)-8-[(E)-3-(4-chlorophenyl)-3-oxoprop-1-enyl]-2-oxo-8-azabicyclo[3.2.1]oct-3-ene-6-carboxylate Traditional Name: (6S)-8-[(E)-3-(4-chlorophenyl)-3-keto-prop-1-enyl]-2-keto-8-azabicyclo[3.2.1]oct-3-ene-6-carboxylic acid methyl ester Formula: C18H16ClNO4 MolecularWeight: 345.77694

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CC2C(=O)C=CC1N2C=CC(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

COC(=O)[C@H]1CC2C(=O)C=CC1N2/C=C/C(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C18H16ClNO4/c1-24-18(23)13-10-15-17(22)7-6-14(13)20(15)9-8-16(21)11-2-4-12(19)5-3-11/h2-9,13-15H,10H2,1H3/b9-8+/t13-,14?,15?/m0/s1