N-[[1-[(4-bromophenyl)methyl]pyrrol-2-yl]methyl]-N-butyl-naphthalene-2-carboxamide

Systemtic Name: N-[[1-[(4-bromophenyl)methyl]pyrrol-2-yl]methyl]-N-butyl-naphthalene-2-carboxamide Openeye Name: N-[[1-[(4-bromophenyl)methyl]pyrrol-2-yl]methyl]-N-butyl-naphthalene-2-carboxamide CAS Name: N-[[1-[(4-bromophenyl)methyl]-2-pyrrolyl]methyl]-N-butyl-2-naphthalenecarboxamide IUPAC Name: N-[[1-[(4-bromophenyl)methyl]pyrrol-2-yl]methyl]-N-butylnaphthalene-2-carboxamide Traditional Name: N-[[1-(4-bromobenzyl)pyrrol-2-yl]methyl]-N-butyl-2-naphthamide Formula: C27H27BrN2O MolecularWeight: 475.42008

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CC1=CC=CN1CC2=CC=C(C=C2)Br)C(=O)C3=CC4=CC=CC=C4C=C3

Isomeric SMILES

CCCCN(CC1=CC=CN1CC2=CC=C(C=C2)Br)C(=O)C3=CC4=CC=CC=C4C=C3

InChI

InChI=1S/C27H27BrN2O/c1-2-3-16-30(27(31)24-13-12-22-7-4-5-8-23(22)18-24)20-26-9-6-17-29(26)19-21-10-14-25(28)15-11-21/h4-15,17-18H,2-3,16,19-20H2,1H3