5-[(E)-3-[3-(2-azanylethoxy)phenyl]-3-oxidanylidene-prop-1-enyl]-2-(carboxymethyloxy)benzoate

Systemtic Name: 5-[(E)-3-[3-(2-azanylethoxy)phenyl]-3-oxidanylidene-prop-1-enyl]-2-(carboxymethyloxy)benzoate Openeye Name: 5-[(E)-3-[3-(2-aminoethoxy)phenyl]-3-oxo-prop-1-enyl]-2-(carboxymethyloxy)benzoate CAS Name: 5-[(E)-3-[3-(2-aminoethoxy)phenyl]-3-oxoprop-1-enyl]-2-(carboxymethyloxy)benzoate IUPAC Name: 5-[(E)-3-[3-(2-aminoethoxy)phenyl]-3-oxoprop-1-enyl]-2-(carboxymethyloxy)benzoate Traditional Name: 5-[(E)-3-[3-(2-aminoethoxy)phenyl]-3-keto-prop-1-enyl]-2-(carboxymethyloxy)benzoate Formula: C20H18NO7- MolecularWeight: 384.35942

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)OCCN)C(=O)C=CC2=CC(=C(C=C2)OCC(=O)O)C(=O)[O-]

Isomeric SMILES

C1=CC(=CC(=C1)OCCN)C(=O)/C=C/C2=CC(=C(C=C2)OCC(=O)O)C(=O)[O-]

InChI

InChI=1S/C20H19NO7/c21-8-9-27-15-3-1-2-14(11-15)17(22)6-4-13-5-7-18(28-12-19(23)24)16(10-13)20(25)26/h1-7,10-11H,8-9,12,21H2,(H,23,24)(H,25,26)/p-1/b6-4+