2-phenyl-N-[[5-(1,2,3,4-tetrazol-1-yl)-1-benzofuran-7-yl]methyl]piperidin-3-amine

Systemtic Name: 2-phenyl-N-[[5-(1,2,3,4-tetrazol-1-yl)-1-benzofuran-7-yl]methyl]piperidin-3-amine Openeye Name: 2-phenyl-N-[[5-(tetrazol-1-yl)benzofuran-7-yl]methyl]piperidin-3-amine CAS Name: 2-phenyl-N-[[5-(1-tetrazolyl)-7-benzofuranyl]methyl]-3-piperidinamine IUPAC Name: 2-phenyl-N-[[5-(tetrazol-1-yl)-1-benzofuran-7-yl]methyl]piperidin-3-amine Traditional Name: (2-phenyl-3-piperidyl)-[[5-(tetrazol-1-yl)benzofuran-7-yl]methyl]amine Formula: C21H22N6O MolecularWeight: 374.43898

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C(NC1)C2=CC=CC=C2)NCC3=C4C(=CC(=C3)N5C=NN=N5)C=CO4

Isomeric SMILES

C1CC(C(NC1)C2=CC=CC=C2)NCC3=C4C(=CC(=C3)N5C=NN=N5)C=CO4

InChI

InChI=1S/C21H22N6O/c1-2-5-15(6-3-1)20-19(7-4-9-22-20)23-13-17-12-18(27-14-24-25-26-27)11-16-8-10-28-21(16)17/h1-3,5-6,8,10-12,14,19-20,22-23H,4,7,9,13H2