disodium 5-[(3-carboxylato-5-chloranyl-4-methoxy-phenyl)-(1-methoxycarbonylpiperidin-4-ylidene)methyl]-3-chloranyl-2-methoxy-benzoate

Systemtic Name: disodium 5-[(3-carboxylato-5-chloranyl-4-methoxy-phenyl)-(1-methoxycarbonylpiperidin-4-ylidene)methyl]-3-chloranyl-2-methoxy-benzoate Openeye Name: disodium 5-[(3-carboxylato-5-chloro-4-methoxy-phenyl)-(1-methoxycarbonyl-4-piperidylidene)methyl]-3-chloro-2-methoxy-benzoate CAS Name: disodium 5-[(3-carboxylato-5-chloro-4-methoxyphenyl)-(1-methoxycarbonyl-4-piperidinylidene)methyl]-3-chloro-2-methoxybenzoate IUPAC Name: disodium 5-[(3-carboxylato-5-chloro-4-methoxyphenyl)-(1-methoxycarbonylpiperidin-4-ylidene)methyl]-3-chloro-2-methoxybenzoate Traditional Name: disodium 5-[(1-carbomethoxy-4-piperidylidene)-(3-carboxylato-5-chloro-4-methoxy-phenyl)methyl]-3-chloro-2-methoxy-benzoate Formula: C24H21Cl2NNa2O8 MolecularWeight: 568.31098

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1Cl)C(=C2CCN(CC2)C(=O)OC)C3=CC(=C(C(=C3)Cl)OC)C(=O)[O-])C(=O)[O-].[Na+].[Na+]

Isomeric SMILES

COC1=C(C=C(C=C1Cl)C(=C2CCN(CC2)C(=O)OC)C3=CC(=C(C(=C3)Cl)OC)C(=O)[O-])C(=O)[O-].[Na+].[Na+]

InChI

InChI=1S/C24H23Cl2NO8.2Na/c1-33-20-15(22(28)29)8-13(10-17(20)25)19(12-4-6-27(7-5-12)24(32)35-3)14-9-16(23(30)31)21(34-2)18(26)11-14;;/h8-11H,4-7H2,1-3H3,(H,28,29)(H,30,31);;/q;2*+1/p-2