ethyl 3-azanyl-1-[3-[4-[(2-methylpropan-2-yl)oxycarbonyl]phenyl]propyl]pyrrole-2-carboxylate

Systemtic Name: ethyl 3-azanyl-1-[3-[4-[(2-methylpropan-2-yl)oxycarbonyl]phenyl]propyl]pyrrole-2-carboxylate Openeye Name: ethyl 3-amino-1-[3-(4-tert-butoxycarbonylphenyl)propyl]pyrrole-2-carboxylate CAS Name: 3-amino-1-[3-[4-[(2-methylpropan-2-yl)oxy-oxomethyl]phenyl]propyl]-2-pyrrolecarboxylic acid ethyl ester IUPAC Name: ethyl 3-amino-1-[3-[4-[(2-methylpropan-2-yl)oxycarbonyl]phenyl]propyl]pyrrole-2-carboxylate Traditional Name: 3-amino-1-[3-(4-tert-butoxycarbonylphenyl)propyl]pyrrole-2-carboxylic acid ethyl ester Formula: C21H28N2O4 MolecularWeight: 372.45802

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C=CN1CCCC2=CC=C(C=C2)C(=O)OC(C)(C)C)N

Isomeric SMILES

CCOC(=O)C1=C(C=CN1CCCC2=CC=C(C=C2)C(=O)OC(C)(C)C)N

InChI

InChI=1S/C21H28N2O4/c1-5-26-20(25)18-17(22)12-14-23(18)13-6-7-15-8-10-16(11-9-15)19(24)27-21(2,3)4/h8-12,14H,5-7,13,22H2,1-4H3