3-[5-(azepan-4-ylmethyl)-1,2,3,4-tetrazol-1-yl]aniline

Systemtic Name: 3-[5-(azepan-4-ylmethyl)-1,2,3,4-tetrazol-1-yl]aniline Openeye Name: 3-[5-(azepan-4-ylmethyl)tetrazol-1-yl]aniline CAS Name: 3-[5-(4-azepanylmethyl)-1-tetrazolyl]aniline IUPAC Name: 3-[5-(azepan-4-ylmethyl)tetrazol-1-yl]aniline Traditional Name: [3-[5-(azepan-4-ylmethyl)tetrazol-1-yl]phenyl]amine Formula: C14H20N6 MolecularWeight: 272.3488

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCNC1)CC2=NN=NN2C3=CC(=CC=C3)N

Isomeric SMILES

C1CC(CCNC1)CC2=NN=NN2C3=CC(=CC=C3)N

InChI

InChI=1S/C14H20N6/c15-12-4-1-5-13(10-12)20-14(17-18-19-20)9-11-3-2-7-16-8-6-11/h1,4-5,10-11,16H,2-3,6-9,15H2