methyl 4-[2-(cyclohexylamino)propanoyl]-1,3,5-trimethyl-pyrrole-2-carboxylate

Systemtic Name: methyl 4-[2-(cyclohexylamino)propanoyl]-1,3,5-trimethyl-pyrrole-2-carboxylate Openeye Name: methyl 4-[2-(cyclohexylamino)propanoyl]-1,3,5-trimethyl-pyrrole-2-carboxylate CAS Name: 4-[2-(cyclohexylamino)-1-oxopropyl]-1,3,5-trimethyl-2-pyrrolecarboxylic acid methyl ester IUPAC Name: methyl 4-[2-(cyclohexylamino)propanoyl]-1,3,5-trimethylpyrrole-2-carboxylate Traditional Name: 4-[2-(cyclohexylamino)propanoyl]-1,3,5-trimethyl-pyrrole-2-carboxylic acid methyl ester Formula: C18H28N2O3 MolecularWeight: 320.42652

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(C(=C1C(=O)C(C)NC2CCCCC2)C)C)C(=O)OC

Isomeric SMILES

CC1=C(N(C(=C1C(=O)C(C)NC2CCCCC2)C)C)C(=O)OC

InChI

InChI=1S/C18H28N2O3/c1-11-15(13(3)20(4)16(11)18(22)23-5)17(21)12(2)19-14-9-7-6-8-10-14/h12,14,19H,6-10H2,1-5H3