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

Systemtic Name: (E)-N-[[1-[(4-bromophenyl)methyl]pyrrol-2-yl]methyl]-N-butyl-3-(4-nitrophenyl)prop-2-enamide Openeye Name: (E)-N-[[1-[(4-bromophenyl)methyl]pyrrol-2-yl]methyl]-N-butyl-3-(4-nitrophenyl)prop-2-enamide CAS Name: (E)-N-[[1-[(4-bromophenyl)methyl]-2-pyrrolyl]methyl]-N-butyl-3-(4-nitrophenyl)-2-propenamide IUPAC Name: (E)-N-[[1-[(4-bromophenyl)methyl]pyrrol-2-yl]methyl]-N-butyl-3-(4-nitrophenyl)prop-2-enamide Traditional Name: (E)-N-[[1-(4-bromobenzyl)pyrrol-2-yl]methyl]-N-butyl-3-(4-nitrophenyl)acrylamide Formula: C25H26BrN3O3 MolecularWeight: 496.39624

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CC1=CC=CN1CC2=CC=C(C=C2)Br)C(=O)C=CC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CCCCN(CC1=CC=CN1CC2=CC=C(C=C2)Br)C(=O)/C=C/C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C25H26BrN3O3/c1-2-3-16-28(25(30)15-10-20-8-13-23(14-9-20)29(31)32)19-24-5-4-17-27(24)18-21-6-11-22(26)12-7-21/h4-15,17H,2-3,16,18-19H2,1H3/b15-10+