ethyl 4-[[2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-phenyl-propanoyl]amino]-1H-pyrrole-2-carboxylate

Systemtic Name: ethyl 4-[[2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-phenyl-propanoyl]amino]-1H-pyrrole-2-carboxylate Openeye Name: ethyl 4-[[2-(tert-butoxycarbonylamino)-3-phenyl-propanoyl]amino]-1H-pyrrole-2-carboxylate CAS Name: 4-[[2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-1-oxo-3-phenylpropyl]amino]-1H-pyrrole-2-carboxylic acid ethyl ester IUPAC Name: ethyl 4-[[2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-phenylpropanoyl]amino]-1H-pyrrole-2-carboxylate Traditional Name: 4-[[2-(tert-butoxycarbonylamino)-3-phenyl-propanoyl]amino]-1H-pyrrole-2-carboxylic acid ethyl ester Formula: C21H27N3O5 MolecularWeight: 401.45618

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CN1)NC(=O)C(CC2=CC=CC=C2)NC(=O)OC(C)(C)C

Isomeric SMILES

CCOC(=O)C1=CC(=CN1)NC(=O)C(CC2=CC=CC=C2)NC(=O)OC(C)(C)C

InChI

InChI=1S/C21H27N3O5/c1-5-28-19(26)17-12-15(13-22-17)23-18(25)16(11-14-9-7-6-8-10-14)24-20(27)29-21(2,3)4/h6-10,12-13,16,22H,5,11H2,1-4H3,(H,23,25)(H,24,27)