5-[[2-(cycloheptylmethyl)-5-naphthalen-2-yl-1H-pyrrol-3-yl]carbonylamino]benzene-1,3-dicarboxylic acid

Systemtic Name: 5-[[2-(cycloheptylmethyl)-5-naphthalen-2-yl-1H-pyrrol-3-yl]carbonylamino]benzene-1,3-dicarboxylic acid Openeye Name: 5-[[2-(cycloheptylmethyl)-5-(2-naphthyl)-1H-pyrrole-3-carbonyl]amino]benzene-1,3-dicarboxylic acid CAS Name: 5-[[[2-(cycloheptylmethyl)-5-(2-naphthalenyl)-1H-pyrrol-3-yl]-oxomethyl]amino]benzene-1,3-dicarboxylic acid IUPAC Name: 5-[[2-(cycloheptylmethyl)-5-naphthalen-2-yl-1H-pyrrole-3-carbonyl]amino]benzene-1,3-dicarboxylic acid Traditional Name: 5-[[2-(cycloheptylmethyl)-5-(2-naphthyl)-1H-pyrrole-3-carbonyl]amino]isophthalic acid Formula: C31H30N2O5 MolecularWeight: 510.5803

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CC1)CC2=C(C=C(N2)C3=CC4=CC=CC=C4C=C3)C(=O)NC5=CC(=CC(=C5)C(=O)O)C(=O)O

Isomeric SMILES

C1CCCC(CC1)CC2=C(C=C(N2)C3=CC4=CC=CC=C4C=C3)C(=O)NC5=CC(=CC(=C5)C(=O)O)C(=O)O

InChI

InChI=1S/C31H30N2O5/c34-29(32-25-16-23(30(35)36)15-24(17-25)31(37)38)26-18-27(22-12-11-20-9-5-6-10-21(20)14-22)33-28(26)13-19-7-3-1-2-4-8-19/h5-6,9-12,14-19,33H,1-4,7-8,13H2,(H,32,34)(H,35,36)(H,37,38)