4-butyl-5-[(3-butyl-5-carboxy-4-methyl-1H-pyrrol-2-yl)-(3-methoxyphenyl)methyl]-3-methyl-1H-pyrrole-2-carboxylic acid

Systemtic Name: 4-butyl-5-[(3-butyl-5-carboxy-4-methyl-1H-pyrrol-2-yl)-(3-methoxyphenyl)methyl]-3-methyl-1H-pyrrole-2-carboxylic acid Openeye Name: 4-butyl-5-[(3-butyl-5-carboxy-4-methyl-1H-pyrrol-2-yl)-(3-methoxyphenyl)methyl]-3-methyl-1H-pyrrole-2-carboxylic acid CAS Name: 4-butyl-5-[(3-butyl-5-carboxy-4-methyl-1H-pyrrol-2-yl)-(3-methoxyphenyl)methyl]-3-methyl-1H-pyrrole-2-carboxylic acid IUPAC Name: 4-butyl-5-[(3-butyl-5-carboxy-4-methyl-1H-pyrrol-2-yl)-(3-methoxyphenyl)methyl]-3-methyl-1H-pyrrole-2-carboxylic acid Traditional Name: 4-butyl-5-[(3-butyl-5-carboxy-4-methyl-1H-pyrrol-2-yl)-(3-methoxyphenyl)methyl]-3-methyl-1H-pyrrole-2-carboxylic acid Formula: C28H36N2O5 MolecularWeight: 480.59584

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(NC(=C1C)C(=O)O)C(C2=CC(=CC=C2)OC)C3=C(C(=C(N3)C(=O)O)C)CCCC

Isomeric SMILES

CCCCC1=C(NC(=C1C)C(=O)O)C(C2=CC(=CC=C2)OC)C3=C(C(=C(N3)C(=O)O)C)CCCC

InChI

InChI=1S/C28H36N2O5/c1-6-8-13-20-16(3)23(27(31)32)29-25(20)22(18-11-10-12-19(15-18)35-5)26-21(14-9-7-2)17(4)24(30-26)28(33)34/h10-12,15,22,29-30H,6-9,13-14H2,1-5H3,(H,31,32)(H,33,34)