3-[3,5-bis(azanyl)-2-methyl-phenyl]propanenitrile

Systemtic Name: 3-[3,5-bis(azanyl)-2-methyl-phenyl]propanenitrile Openeye Name: 3-(3,5-diamino-2-methyl-phenyl)propanenitrile CAS Name: 3-(3,5-diamino-2-methylphenyl)propanenitrile IUPAC Name: 3-(3,5-diamino-2-methylphenyl)propanenitrile Traditional Name: 3-(3,5-diamino-2-methyl-phenyl)propionitrile Formula: C10H13N3 MolecularWeight: 175.23032

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1CCC#N)N)N

Isomeric SMILES

CC1=C(C=C(C=C1CCC#N)N)N

InChI

InChI=1S/C10H13N3/c1-7-8(3-2-4-11)5-9(12)6-10(7)13/h5-6H,2-3,12-13H2,1H3