tert-butyl 2-(ethylamino)-4,5-dimethyl-1-(phenylmethyl)pyrrole-3-carboxylate

Systemtic Name: tert-butyl 2-(ethylamino)-4,5-dimethyl-1-(phenylmethyl)pyrrole-3-carboxylate Openeye Name: tert-butyl 1-benzyl-2-(ethylamino)-4,5-dimethyl-pyrrole-3-carboxylate CAS Name: 2-(ethylamino)-4,5-dimethyl-1-(phenylmethyl)-3-pyrrolecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 1-benzyl-2-(ethylamino)-4,5-dimethylpyrrole-3-carboxylate Traditional Name: 1-benzyl-2-(ethylamino)-4,5-dimethyl-pyrrole-3-carboxylic acid tert-butyl ester Formula: C20H28N2O2 MolecularWeight: 328.44852

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Descriptors Computed from Structure

Canonical SMILES:

CCNC1=C(C(=C(N1CC2=CC=CC=C2)C)C)C(=O)OC(C)(C)C

Isomeric SMILES

CCNC1=C(C(=C(N1CC2=CC=CC=C2)C)C)C(=O)OC(C)(C)C

InChI

InChI=1S/C20H28N2O2/c1-7-21-18-17(19(23)24-20(4,5)6)14(2)15(3)22(18)13-16-11-9-8-10-12-16/h8-12,21H,7,13H2,1-6H3