2-[(4-carboxyphenyl)methyliminomethyl]-5,5-dimethyl-3-oxidanylidene-cyclohexen-1-olate

Systemtic Name: 2-[(4-carboxyphenyl)methyliminomethyl]-5,5-dimethyl-3-oxidanylidene-cyclohexen-1-olate Openeye Name: 2-[(4-carboxyphenyl)methyliminomethyl]-5,5-dimethyl-3-oxo-cyclohexen-1-olate CAS Name: 2-[(4-carboxyphenyl)methyliminomethyl]-5,5-dimethyl-3-oxo-1-cyclohexenolate IUPAC Name: 2-[(4-carboxyphenyl)methyliminomethyl]-5,5-dimethyl-3-oxocyclohexen-1-olate Traditional Name: 2-[(4-carboxybenzyl)iminomethyl]-3-keto-5,5-dimethyl-cyclohexen-1-olate Formula: C17H18NO4- MolecularWeight: 300.32912

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=C(C(=O)C1)C=NCC2=CC=C(C=C2)C(=O)O)[O-])C

Isomeric SMILES

CC1(CC(=C(C(=O)C1)C=NCC2=CC=C(C=C2)C(=O)O)[O-])C

InChI

InChI=1S/C17H19NO4/c1-17(2)7-14(19)13(15(20)8-17)10-18-9-11-3-5-12(6-4-11)16(21)22/h3-6,10,19H,7-9H2,1-2H3,(H,21,22)/p-1