1-[(4-propoxyphenyl)methyl]ethane-1,1,2-tricarboxylate

Systemtic Name: 1-[(4-propoxyphenyl)methyl]ethane-1,1,2-tricarboxylate Openeye Name: 1-[(4-propoxyphenyl)methyl]ethane-1,1,2-tricarboxylate CAS Name: 1-[(4-propoxyphenyl)methyl]ethane-1,1,2-tricarboxylate IUPAC Name: 1-[(4-propoxyphenyl)methyl]ethane-1,1,2-tricarboxylate Traditional Name: 1-(4-propoxybenzyl)ethane-1,1,2-tricarboxylate Formula: C15H15O7-3 MolecularWeight: 307.2754

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)CC(CC(=O)[O-])(C(=O)[O-])C(=O)[O-]

Isomeric SMILES

CCCOC1=CC=C(C=C1)CC(CC(=O)[O-])(C(=O)[O-])C(=O)[O-]

InChI

InChI=1S/C15H18O7/c1-2-7-22-11-5-3-10(4-6-11)8-15(13(18)19,14(20)21)9-12(16)17/h3-6H,2,7-9H2,1H3,(H,16,17)(H,18,19)(H,20,21)/p-3