methyl 3-[2-[(2-methylpropan-2-yl)oxycarbonylamino]ethyl]-5-pyrrol-1-yl-benzoate

Systemtic Name: methyl 3-[2-[(2-methylpropan-2-yl)oxycarbonylamino]ethyl]-5-pyrrol-1-yl-benzoate Openeye Name: methyl 3-[2-(tert-butoxycarbonylamino)ethyl]-5-pyrrol-1-yl-benzoate CAS Name: 3-[2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]ethyl]-5-(1-pyrrolyl)benzoic acid methyl ester IUPAC Name: methyl 3-[2-[(2-methylpropan-2-yl)oxycarbonylamino]ethyl]-5-pyrrol-1-ylbenzoate Traditional Name: 3-[2-(tert-butoxycarbonylamino)ethyl]-5-pyrrol-1-yl-benzoic acid methyl ester Formula: C19H24N2O4 MolecularWeight: 344.40486

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NCCC1=CC(=CC(=C1)C(=O)OC)N2C=CC=C2

Isomeric SMILES

CC(C)(C)OC(=O)NCCC1=CC(=CC(=C1)C(=O)OC)N2C=CC=C2

InChI

InChI=1S/C19H24N2O4/c1-19(2,3)25-18(23)20-8-7-14-11-15(17(22)24-4)13-16(12-14)21-9-5-6-10-21/h5-6,9-13H,7-8H2,1-4H3,(H,20,23)