2-[[3-[(E)-3-(3-ethoxy-4-methoxy-phenyl)prop-2-enoyl]phenyl]sulfonylamino]ethanoic acid

Systemtic Name: 2-[[3-[(E)-3-(3-ethoxy-4-methoxy-phenyl)prop-2-enoyl]phenyl]sulfonylamino]ethanoic acid Openeye Name: 2-[[3-[(E)-3-(3-ethoxy-4-methoxy-phenyl)prop-2-enoyl]phenyl]sulfonylamino]acetic acid CAS Name: 2-[[3-[(E)-3-(3-ethoxy-4-methoxyphenyl)-1-oxoprop-2-enyl]phenyl]sulfonylamino]acetic acid IUPAC Name: 2-[[3-[(E)-3-(3-ethoxy-4-methoxyphenyl)prop-2-enoyl]phenyl]sulfonylamino]acetic acid Traditional Name: 2-[[3-[(E)-3-(3-ethoxy-4-methoxy-phenyl)acryloyl]phenyl]sulfonylamino]acetic acid Formula: C20H21NO7S MolecularWeight: 419.44824

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C=CC(=O)C2=CC(=CC=C2)S(=O)(=O)NCC(=O)O)OC

Isomeric SMILES

CCOC1=C(C=CC(=C1)/C=C/C(=O)C2=CC(=CC=C2)S(=O)(=O)NCC(=O)O)OC

InChI

InChI=1S/C20H21NO7S/c1-3-28-19-11-14(8-10-18(19)27-2)7-9-17(22)15-5-4-6-16(12-15)29(25,26)21-13-20(23)24/h4-12,21H,3,13H2,1-2H3,(H,23,24)/b9-7+