methyl 1-ethyl-3,5-dimethyl-4-[2-(3-methylbutylamino)ethanoyl]pyrrole-2-carboxylate

Systemtic Name: methyl 1-ethyl-3,5-dimethyl-4-[2-(3-methylbutylamino)ethanoyl]pyrrole-2-carboxylate Openeye Name: methyl 1-ethyl-4-[2-(isopentylamino)acetyl]-3,5-dimethyl-pyrrole-2-carboxylate CAS Name: 1-ethyl-3,5-dimethyl-4-[2-(3-methylbutylamino)-1-oxoethyl]-2-pyrrolecarboxylic acid methyl ester IUPAC Name: methyl 1-ethyl-3,5-dimethyl-4-[2-(3-methylbutylamino)acetyl]pyrrole-2-carboxylate Traditional Name: 1-ethyl-4-[2-(isoamylamino)acetyl]-3,5-dimethyl-pyrrole-2-carboxylic acid methyl ester Formula: C17H28N2O3 MolecularWeight: 308.41582

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C(=C1C(=O)OC)C)C(=O)CNCCC(C)C)C

Isomeric SMILES

CCN1C(=C(C(=C1C(=O)OC)C)C(=O)CNCCC(C)C)C

InChI

InChI=1S/C17H28N2O3/c1-7-19-13(5)15(12(4)16(19)17(21)22-6)14(20)10-18-9-8-11(2)3/h11,18H,7-10H2,1-6H3