ethyl 2-methyl-1-[3-oxidanylidene-3-(phenethylamino)propyl]-5-phenyl-pyrrole-3-carboxylate

Systemtic Name: ethyl 2-methyl-1-[3-oxidanylidene-3-(phenethylamino)propyl]-5-phenyl-pyrrole-3-carboxylate Openeye Name: ethyl 2-methyl-1-[3-oxo-3-(phenethylamino)propyl]-5-phenyl-pyrrole-3-carboxylate CAS Name: 2-methyl-1-[3-oxo-3-(phenethylamino)propyl]-5-phenyl-3-pyrrolecarboxylic acid ethyl ester IUPAC Name: ethyl 2-methyl-1-[3-oxo-3-(phenethylamino)propyl]-5-phenylpyrrole-3-carboxylate Traditional Name: 1-[3-keto-3-(phenethylamino)propyl]-2-methyl-5-phenyl-pyrrole-3-carboxylic acid ethyl ester Formula: C25H28N2O3 MolecularWeight: 404.50142

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C(=C1)C2=CC=CC=C2)CCC(=O)NCCC3=CC=CC=C3)C

Isomeric SMILES

CCOC(=O)C1=C(N(C(=C1)C2=CC=CC=C2)CCC(=O)NCCC3=CC=CC=C3)C

InChI

InChI=1S/C25H28N2O3/c1-3-30-25(29)22-18-23(21-12-8-5-9-13-21)27(19(22)2)17-15-24(28)26-16-14-20-10-6-4-7-11-20/h4-13,18H,3,14-17H2,1-2H3,(H,26,28)