2-[tert-butyl-(phenylmethyl)amino]ethanoyl 1H-pyrrole-2-carboxylate

Systemtic Name: 2-[tert-butyl-(phenylmethyl)amino]ethanoyl 1H-pyrrole-2-carboxylate Openeye Name: [2-[benzyl(tert-butyl)amino]acetyl] 1H-pyrrole-2-carboxylate CAS Name: 1H-pyrrole-2-carboxylic acid [2-[tert-butyl-(phenylmethyl)amino]-1-oxoethyl] ester IUPAC Name: [2-[benzyl(tert-butyl)amino]acetyl] 1H-pyrrole-2-carboxylate Traditional Name: 1H-pyrrole-2-carboxylic acid [2-[benzyl(tert-butyl)amino]acetyl] ester Formula: C18H22N2O3 MolecularWeight: 314.37888

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)N(CC1=CC=CC=C1)CC(=O)OC(=O)C2=CC=CN2

Isomeric SMILES

CC(C)(C)N(CC1=CC=CC=C1)CC(=O)OC(=O)C2=CC=CN2

InChI

InChI=1S/C18H22N2O3/c1-18(2,3)20(12-14-8-5-4-6-9-14)13-16(21)23-17(22)15-10-7-11-19-15/h4-11,19H,12-13H2,1-3H3