N-[[2-[4-(pyrrolidin-1-ylmethyl)phenyl]phenyl]methyl]-2H-benzotriazole-5-carboxamide

Systemtic Name: N-[[2-[4-(pyrrolidin-1-ylmethyl)phenyl]phenyl]methyl]-2H-benzotriazole-5-carboxamide Openeye Name: N-[[2-[4-(pyrrolidin-1-ylmethyl)phenyl]phenyl]methyl]-2H-benzotriazole-5-carboxamide CAS Name: N-[[2-[4-(1-pyrrolidinylmethyl)phenyl]phenyl]methyl]-2H-benzotriazole-5-carboxamide IUPAC Name: N-[[2-[4-(pyrrolidin-1-ylmethyl)phenyl]phenyl]methyl]-2H-benzotriazole-5-carboxamide Traditional Name: N-[2-[4-(pyrrolidinomethyl)phenyl]benzyl]-2H-benzotriazole-5-carboxamide Formula: C25H25N5O MolecularWeight: 411.4989

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CC2=CC=C(C=C2)C3=CC=CC=C3CNC(=O)C4=CC5=NNN=C5C=C4

Isomeric SMILES

C1CCN(C1)CC2=CC=C(C=C2)C3=CC=CC=C3CNC(=O)C4=CC5=NNN=C5C=C4

InChI

InChI=1S/C25H25N5O/c31-25(20-11-12-23-24(15-20)28-29-27-23)26-16-21-5-1-2-6-22(21)19-9-7-18(8-10-19)17-30-13-3-4-14-30/h1-2,5-12,15H,3-4,13-14,16-17H2,(H,26,31)(H,27,28,29)