ethyl 1-[2-(butan-2-ylamino)-2-oxidanylidene-ethyl]-2,4-dimethyl-5-phenyl-pyrrole-3-carboxylate

Systemtic Name: ethyl 1-[2-(butan-2-ylamino)-2-oxidanylidene-ethyl]-2,4-dimethyl-5-phenyl-pyrrole-3-carboxylate Openeye Name: ethyl 2,4-dimethyl-1-[2-oxo-2-(sec-butylamino)ethyl]-5-phenyl-pyrrole-3-carboxylate CAS Name: 1-[2-(butan-2-ylamino)-2-oxoethyl]-2,4-dimethyl-5-phenyl-3-pyrrolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[2-(butan-2-ylamino)-2-oxoethyl]-2,4-dimethyl-5-phenylpyrrole-3-carboxylate Traditional Name: 1-[2-keto-2-(sec-butylamino)ethyl]-2,4-dimethyl-5-phenyl-pyrrole-3-carboxylic acid ethyl ester Formula: C21H28N2O3 MolecularWeight: 356.45862

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)CN1C(=C(C(=C1C2=CC=CC=C2)C)C(=O)OCC)C

Isomeric SMILES

CCC(C)NC(=O)CN1C(=C(C(=C1C2=CC=CC=C2)C)C(=O)OCC)C

InChI

InChI=1S/C21H28N2O3/c1-6-14(3)22-18(24)13-23-16(5)19(21(25)26-7-2)15(4)20(23)17-11-9-8-10-12-17/h8-12,14H,6-7,13H2,1-5H3,(H,22,24)