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

Systemtic Name: 2-[[3-[(E)-3-(4-methoxy-3-oxidanyl-phenyl)prop-2-enoyl]phenyl]sulfonylamino]ethanoic acid Openeye Name: 2-[[3-[(E)-3-(3-hydroxy-4-methoxy-phenyl)prop-2-enoyl]phenyl]sulfonylamino]acetic acid CAS Name: 2-[[3-[(E)-3-(3-hydroxy-4-methoxyphenyl)-1-oxoprop-2-enyl]phenyl]sulfonylamino]acetic acid IUPAC Name: 2-[[3-[(E)-3-(3-hydroxy-4-methoxyphenyl)prop-2-enoyl]phenyl]sulfonylamino]acetic acid Traditional Name: 2-[[3-[(E)-3-(3-hydroxy-4-methoxy-phenyl)acryloyl]phenyl]sulfonylamino]acetic acid Formula: C18H17NO7S MolecularWeight: 391.39508

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C=CC(=O)C2=CC(=CC=C2)S(=O)(=O)NCC(=O)O)O

Isomeric SMILES

COC1=C(C=C(C=C1)/C=C/C(=O)C2=CC(=CC=C2)S(=O)(=O)NCC(=O)O)O

InChI

InChI=1S/C18H17NO7S/c1-26-17-8-6-12(9-16(17)21)5-7-15(20)13-3-2-4-14(10-13)27(24,25)19-11-18(22)23/h2-10,19,21H,11H2,1H3,(H,22,23)/b7-5+