(E)-2-benzamido-3-(4-butoxy-3-chloranyl-5-methoxy-phenyl)prop-2-enoic acid

Systemtic Name: (E)-2-benzamido-3-(4-butoxy-3-chloranyl-5-methoxy-phenyl)prop-2-enoic acid Openeye Name: (E)-2-benzamido-3-(4-butoxy-3-chloro-5-methoxy-phenyl)prop-2-enoic acid CAS Name: (E)-2-benzamido-3-(4-butoxy-3-chloro-5-methoxyphenyl)-2-propenoic acid IUPAC Name: (E)-2-benzamido-3-(4-butoxy-3-chloro-5-methoxyphenyl)prop-2-enoic acid Traditional Name: (E)-2-benzamido-3-(4-butoxy-3-chloro-5-methoxy-phenyl)acrylic acid Formula: C21H22ClNO5 MolecularWeight: 403.85608

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1Cl)C=C(C(=O)O)NC(=O)C2=CC=CC=C2)OC

Isomeric SMILES

CCCCOC1=C(C=C(C=C1Cl)/C=C(\C(=O)O)/NC(=O)C2=CC=CC=C2)OC

InChI

InChI=1S/C21H22ClNO5/c1-3-4-10-28-19-16(22)11-14(13-18(19)27-2)12-17(21(25)26)23-20(24)15-8-6-5-7-9-15/h5-9,11-13H,3-4,10H2,1-2H3,(H,23,24)(H,25,26)/b17-12+