5-chloranyl-2-methoxy-4-[[(E)-3-(3-methoxy-4-pentoxy-phenyl)prop-2-enoyl]amino]benzoic acid

Systemtic Name: 5-chloranyl-2-methoxy-4-[[(E)-3-(3-methoxy-4-pentoxy-phenyl)prop-2-enoyl]amino]benzoic acid Openeye Name: 5-chloro-2-methoxy-4-[[(E)-3-(3-methoxy-4-pentoxy-phenyl)prop-2-enoyl]amino]benzoic acid CAS Name: 5-chloro-2-methoxy-4-[[(E)-3-(3-methoxy-4-pentoxyphenyl)-1-oxoprop-2-enyl]amino]benzoic acid IUPAC Name: 5-chloro-2-methoxy-4-[[(E)-3-(3-methoxy-4-pentoxyphenyl)prop-2-enoyl]amino]benzoic acid Traditional Name: 4-[[(E)-3-(4-amoxy-3-methoxy-phenyl)acryloyl]amino]-5-chloro-2-methoxy-benzoic acid Formula: C23H26ClNO6 MolecularWeight: 447.90864

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=C(C=C(C=C1)C=CC(=O)NC2=C(C=C(C(=C2)OC)C(=O)O)Cl)OC

Isomeric SMILES

CCCCCOC1=C(C=C(C=C1)/C=C/C(=O)NC2=C(C=C(C(=C2)OC)C(=O)O)Cl)OC

InChI

InChI=1S/C23H26ClNO6/c1-4-5-6-11-31-19-9-7-15(12-21(19)30-3)8-10-22(26)25-18-14-20(29-2)16(23(27)28)13-17(18)24/h7-10,12-14H,4-6,11H2,1-3H3,(H,25,26)(H,27,28)/b10-8+