7-[(3,5-ditert-butyl-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)methylamino]-3-methyl-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate

Systemtic Name: 7-[(3,5-ditert-butyl-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)methylamino]-3-methyl-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate Openeye Name: 7-[(3,5-ditert-butyl-4-oxo-cyclohexa-2,5-dien-1-ylidene)methylamino]-3-methyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate CAS Name: 7-[(3,5-ditert-butyl-4-oxo-1-cyclohexa-2,5-dienylidene)methylamino]-3-methyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate IUPAC Name: 7-[(3,5-ditert-butyl-4-oxocyclohexa-2,5-dien-1-ylidene)methylamino]-3-methyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate Traditional Name: 7-[(3,5-ditert-butyl-4-keto-cyclohexa-2,5-dien-1-ylidene)methylamino]-8-keto-3-methyl-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate Formula: C23H29N2O4S- MolecularWeight: 429.55236

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N2C(C(C2=O)NC=C3C=C(C(=O)C(=C3)C(C)(C)C)C(C)(C)C)SC1)C(=O)[O-]

Isomeric SMILES

CC1=C(N2C(C(C2=O)NC=C3C=C(C(=O)C(=C3)C(C)(C)C)C(C)(C)C)SC1)C(=O)[O-]

InChI

InChI=1S/C23H30N2O4S/c1-12-11-30-20-16(19(27)25(20)17(12)21(28)29)24-10-13-8-14(22(2,3)4)18(26)15(9-13)23(5,6)7/h8-10,16,20,24H,11H2,1-7H3,(H,28,29)/p-1