ethyl 2-methyl-1-[3-[(4-methylcyclohexyl)carbamoyl]phenyl]-5-phenyl-pyrrole-3-carboxylate

Systemtic Name: ethyl 2-methyl-1-[3-[(4-methylcyclohexyl)carbamoyl]phenyl]-5-phenyl-pyrrole-3-carboxylate Openeye Name: ethyl 2-methyl-1-[3-[(4-methylcyclohexyl)carbamoyl]phenyl]-5-phenyl-pyrrole-3-carboxylate CAS Name: 2-methyl-1-[3-[[(4-methylcyclohexyl)amino]-oxomethyl]phenyl]-5-phenyl-3-pyrrolecarboxylic acid ethyl ester IUPAC Name: ethyl 2-methyl-1-[3-[(4-methylcyclohexyl)carbamoyl]phenyl]-5-phenylpyrrole-3-carboxylate Traditional Name: 2-methyl-1-[3-[(4-methylcyclohexyl)carbamoyl]phenyl]-5-phenyl-pyrrole-3-carboxylic acid ethyl ester Formula: C28H32N2O3 MolecularWeight: 444.56528

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C(=C1)C2=CC=CC=C2)C3=CC=CC(=C3)C(=O)NC4CCC(CC4)C)C

Isomeric SMILES

CCOC(=O)C1=C(N(C(=C1)C2=CC=CC=C2)C3=CC=CC(=C3)C(=O)NC4CCC(CC4)C)C

InChI

InChI=1S/C28H32N2O3/c1-4-33-28(32)25-18-26(21-9-6-5-7-10-21)30(20(25)3)24-12-8-11-22(17-24)27(31)29-23-15-13-19(2)14-16-23/h5-12,17-19,23H,4,13-16H2,1-3H3,(H,29,31)