tert-butyl N-[2,5-dimethyl-3-(phenylcarbonyl)pyrrol-1-yl]carbamate

Systemtic Name: tert-butyl N-[2,5-dimethyl-3-(phenylcarbonyl)pyrrol-1-yl]carbamate Openeye Name: tert-butyl N-(3-benzoyl-2,5-dimethyl-pyrrol-1-yl)carbamate CAS Name: N-(3-benzoyl-2,5-dimethyl-1-pyrrolyl)carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-(3-benzoyl-2,5-dimethylpyrrol-1-yl)carbamate Traditional Name: N-(3-benzoyl-2,5-dimethyl-pyrrol-1-yl)carbamic acid tert-butyl ester Formula: C18H22N2O3 MolecularWeight: 314.37888

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1NC(=O)OC(C)(C)C)C)C(=O)C2=CC=CC=C2

Isomeric SMILES

CC1=CC(=C(N1NC(=O)OC(C)(C)C)C)C(=O)C2=CC=CC=C2

InChI

InChI=1S/C18H22N2O3/c1-12-11-15(16(21)14-9-7-6-8-10-14)13(2)20(12)19-17(22)23-18(3,4)5/h6-11H,1-5H3,(H,19,22)