methyl 5-tert-butyl-1-[(2S)-2-(phenylmethoxycarbonylamino)propyl]-2-propyl-pyrrole-3-carboxylate

Systemtic Name: methyl 5-tert-butyl-1-[(2S)-2-(phenylmethoxycarbonylamino)propyl]-2-propyl-pyrrole-3-carboxylate Openeye Name: methyl 1-[(2S)-2-(benzyloxycarbonylamino)propyl]-5-tert-butyl-2-propyl-pyrrole-3-carboxylate CAS Name: 5-tert-butyl-1-[(2S)-2-(phenylmethoxycarbonylamino)propyl]-2-propyl-3-pyrrolecarboxylic acid methyl ester IUPAC Name: methyl 5-tert-butyl-1-[(2S)-2-(phenylmethoxycarbonylamino)propyl]-2-propylpyrrole-3-carboxylate Traditional Name: 1-[(2S)-2-(benzyloxycarbonylamino)propyl]-5-tert-butyl-2-propyl-pyrrole-3-carboxylic acid methyl ester Formula: C24H34N2O4 MolecularWeight: 414.53776

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=C(N1CC(C)NC(=O)OCC2=CC=CC=C2)C(C)(C)C)C(=O)OC

Isomeric SMILES

CCCC1=C(C=C(N1C[C@H](C)NC(=O)OCC2=CC=CC=C2)C(C)(C)C)C(=O)OC

InChI

InChI=1S/C24H34N2O4/c1-7-11-20-19(22(27)29-6)14-21(24(3,4)5)26(20)15-17(2)25-23(28)30-16-18-12-9-8-10-13-18/h8-10,12-14,17H,7,11,15-16H2,1-6H3,(H,25,28)/t17-/m0/s1