2-[5-(4-ethoxyphenyl)carbonyl-1-(phenylmethyl)pyrrol-2-yl]ethanoic acid; methane

Systemtic Name: 2-[5-(4-ethoxyphenyl)carbonyl-1-(phenylmethyl)pyrrol-2-yl]ethanoic acid; methane Openeye Name: 2-[1-benzyl-5-(4-ethoxybenzoyl)pyrrol-2-yl]acetic acid; methane CAS Name: 2-[5-[(4-ethoxyphenyl)-oxomethyl]-1-(phenylmethyl)-2-pyrrolyl]acetic acid; methane IUPAC Name: 2-[1-benzyl-5-(4-ethoxybenzoyl)pyrrol-2-yl]acetic acid; methane Traditional Name: 2-[1-benzyl-5-(4-ethoxybenzoyl)pyrrol-2-yl]acetic acid; methane Formula: C23H25NO4 MolecularWeight: 379.4489

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Descriptors Computed from Structure

Canonical SMILES:

C.CCOC1=CC=C(C=C1)C(=O)C2=CC=C(N2CC3=CC=CC=C3)CC(=O)O

Isomeric SMILES

C.CCOC1=CC=C(C=C1)C(=O)C2=CC=C(N2CC3=CC=CC=C3)CC(=O)O

InChI

InChI=1S/C22H21NO4.CH4/c1-2-27-19-11-8-17(9-12-19)22(26)20-13-10-18(14-21(24)25)23(20)15-16-6-4-3-5-7-16;/h3-13H,2,14-15H2,1H3,(H,24,25);1H4