5-chloranyl-2-[(E)-3-[2-(4-hydroxyphenyl)carbonylpyrrol-1-yl]prop-1-enyl]benzoic acid

Systemtic Name: 5-chloranyl-2-[(E)-3-[2-(4-hydroxyphenyl)carbonylpyrrol-1-yl]prop-1-enyl]benzoic acid Openeye Name: 5-chloro-2-[(E)-3-[2-(4-hydroxybenzoyl)pyrrol-1-yl]prop-1-enyl]benzoic acid CAS Name: 5-chloro-2-[(E)-3-[2-[(4-hydroxyphenyl)-oxomethyl]-1-pyrrolyl]prop-1-enyl]benzoic acid IUPAC Name: 5-chloro-2-[(E)-3-[2-(4-hydroxybenzoyl)pyrrol-1-yl]prop-1-enyl]benzoic acid Traditional Name: 5-chloro-2-[(E)-3-[2-(4-hydroxybenzoyl)pyrrol-1-yl]prop-1-enyl]benzoic acid Formula: C21H16ClNO4 MolecularWeight: 381.80904

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN(C(=C1)C(=O)C2=CC=C(C=C2)O)CC=CC3=C(C=C(C=C3)Cl)C(=O)O

Isomeric SMILES

C1=CN(C(=C1)C(=O)C2=CC=C(C=C2)O)C/C=C/C3=C(C=C(C=C3)Cl)C(=O)O

InChI

InChI=1S/C21H16ClNO4/c22-16-8-5-14(18(13-16)21(26)27)3-1-11-23-12-2-4-19(23)20(25)15-6-9-17(24)10-7-15/h1-10,12-13,24H,11H2,(H,26,27)/b3-1+