(E)-N-[[1-[(4-bromophenyl)methyl]pyrrol-2-yl]methyl]-N-butyl-3-phenyl-prop-2-enamide

Systemtic Name: (E)-N-[[1-[(4-bromophenyl)methyl]pyrrol-2-yl]methyl]-N-butyl-3-phenyl-prop-2-enamide Openeye Name: (E)-N-[[1-[(4-bromophenyl)methyl]pyrrol-2-yl]methyl]-N-butyl-3-phenyl-prop-2-enamide CAS Name: (E)-N-[[1-[(4-bromophenyl)methyl]-2-pyrrolyl]methyl]-N-butyl-3-phenyl-2-propenamide IUPAC Name: (E)-N-[[1-[(4-bromophenyl)methyl]pyrrol-2-yl]methyl]-N-butyl-3-phenylprop-2-enamide Traditional Name: (E)-N-[[1-(4-bromobenzyl)pyrrol-2-yl]methyl]-N-butyl-3-phenyl-acrylamide Formula: C25H27BrN2O MolecularWeight: 451.39868

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CC1=CC=CN1CC2=CC=C(C=C2)Br)C(=O)C=CC3=CC=CC=C3

Isomeric SMILES

CCCCN(CC1=CC=CN1CC2=CC=C(C=C2)Br)C(=O)/C=C/C3=CC=CC=C3

InChI

InChI=1S/C25H27BrN2O/c1-2-3-17-28(25(29)16-13-21-8-5-4-6-9-21)20-24-10-7-18-27(24)19-22-11-14-23(26)15-12-22/h4-16,18H,2-3,17,19-20H2,1H3/b16-13+