N-butan-2-yl-3-methyl-4-(1,2,3,4-tetrazol-1-yl)aniline

Systemtic Name: N-butan-2-yl-3-methyl-4-(1,2,3,4-tetrazol-1-yl)aniline Openeye Name: 3-methyl-N-sec-butyl-4-(tetrazol-1-yl)aniline CAS Name: N-butan-2-yl-3-methyl-4-(1-tetrazolyl)aniline IUPAC Name: N-butan-2-yl-3-methyl-4-(tetrazol-1-yl)aniline Traditional Name: [3-methyl-4-(tetrazol-1-yl)phenyl]-sec-butyl-amine Formula: C12H17N5 MolecularWeight: 231.29688

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC1=CC(=C(C=C1)N2C=NN=N2)C

Isomeric SMILES

CCC(C)NC1=CC(=C(C=C1)N2C=NN=N2)C

InChI

InChI=1S/C12H17N5/c1-4-10(3)14-11-5-6-12(9(2)7-11)17-8-13-15-16-17/h5-8,10,14H,4H2,1-3H3