1-[(5-carboxy-3-ethyl-4-methyl-1H-pyrrol-2-yl)methyl]-2H-phenanthro[9,10-c]pyrrole-3-carboxylic acid

Systemtic Name: 1-[(5-carboxy-3-ethyl-4-methyl-1H-pyrrol-2-yl)methyl]-2H-phenanthro[9,10-c]pyrrole-3-carboxylic acid Openeye Name: 1-[(5-carboxy-3-ethyl-4-methyl-1H-pyrrol-2-yl)methyl]-2H-phenanthro[9,10-c]pyrrole-3-carboxylic acid CAS Name: 1-[(5-carboxy-3-ethyl-4-methyl-1H-pyrrol-2-yl)methyl]-2H-phenanthro[9,10-c]pyrrole-3-carboxylic acid IUPAC Name: 1-[(5-carboxy-3-ethyl-4-methyl-1H-pyrrol-2-yl)methyl]-2H-phenanthro[9,10-c]pyrrole-3-carboxylic acid Traditional Name: 1-[(5-carboxy-3-ethyl-4-methyl-1H-pyrrol-2-yl)methyl]-2H-phenanthro[9,10-c]pyrrole-3-carboxylic acid Formula: C26H22N2O4 MolecularWeight: 426.46388

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(NC(=C1C)C(=O)O)CC2=C3C4=CC=CC=C4C5=CC=CC=C5C3=C(N2)C(=O)O

Isomeric SMILES

CCC1=C(NC(=C1C)C(=O)O)CC2=C3C4=CC=CC=C4C5=CC=CC=C5C3=C(N2)C(=O)O

InChI

InChI=1S/C26H22N2O4/c1-3-14-13(2)23(25(29)30)27-19(14)12-20-21-17-10-6-4-8-15(17)16-9-5-7-11-18(16)22(21)24(28-20)26(31)32/h4-11,27-28H,3,12H2,1-2H3,(H,29,30)(H,31,32)