4-(3-azanyl-1-imidazol-1-yl-propyl)aniline

Systemtic Name: 4-(3-azanyl-1-imidazol-1-yl-propyl)aniline Openeye Name: 4-(3-amino-1-imidazol-1-yl-propyl)aniline CAS Name: 4-[3-amino-1-(1-imidazolyl)propyl]aniline IUPAC Name: 4-(3-amino-1-imidazol-1-ylpropyl)aniline Traditional Name: [4-(3-amino-1-imidazol-1-yl-propyl)phenyl]amine Formula: C12H16N4 MolecularWeight: 216.28224

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(CCN)N2C=CN=C2)N

Isomeric SMILES

C1=CC(=CC=C1C(CCN)N2C=CN=C2)N

InChI

InChI=1S/C12H16N4/c13-6-5-12(16-8-7-15-9-16)10-1-3-11(14)4-2-10/h1-4,7-9,12H,5-6,13-14H2