4-[(4-methylcyclohexyl)carbonyl-(oxolan-3-yl)amino]-1-phenyl-pyrrole-3-carboxylic acid

Systemtic Name: 4-[(4-methylcyclohexyl)carbonyl-(oxolan-3-yl)amino]-1-phenyl-pyrrole-3-carboxylic acid Openeye Name: 4-[(4-methylcyclohexanecarbonyl)-tetrahydrofuran-3-yl-amino]-1-phenyl-pyrrole-3-carboxylic acid CAS Name: 4-[[(4-methylcyclohexyl)-oxomethyl]-(3-oxolanyl)amino]-1-phenyl-3-pyrrolecarboxylic acid IUPAC Name: 4-[(4-methylcyclohexanecarbonyl)-(oxolan-3-yl)amino]-1-phenylpyrrole-3-carboxylic acid Traditional Name: 4-[(4-methylcyclohexanecarbonyl)-tetrahydrofuran-3-yl-amino]-1-phenyl-pyrrole-3-carboxylic acid Formula: C23H28N2O4 MolecularWeight: 396.47942

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(CC1)C(=O)N(C2CCOC2)C3=CN(C=C3C(=O)O)C4=CC=CC=C4

Isomeric SMILES

CC1CCC(CC1)C(=O)N(C2CCOC2)C3=CN(C=C3C(=O)O)C4=CC=CC=C4

InChI

InChI=1S/C23H28N2O4/c1-16-7-9-17(10-8-16)22(26)25(19-11-12-29-15-19)21-14-24(13-20(21)23(27)28)18-5-3-2-4-6-18/h2-6,13-14,16-17,19H,7-12,15H2,1H3,(H,27,28)