N5-[(4-methylphenyl)methyl]isoquinoline-5,8-diamine

Systemtic Name: N5-[(4-methylphenyl)methyl]isoquinoline-5,8-diamine Openeye Name: N5-(p-tolylmethyl)isoquinoline-5,8-diamine CAS Name: N5-[(4-methylphenyl)methyl]isoquinoline-5,8-diamine IUPAC Name: 5-N-[(4-methylphenyl)methyl]isoquinoline-5,8-diamine Traditional Name: (8-amino-5-isoquinolyl)-(4-methylbenzyl)amine Formula: C17H17N3 MolecularWeight: 263.33698

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CNC2=C3C=CN=CC3=C(C=C2)N

Isomeric SMILES

CC1=CC=C(C=C1)CNC2=C3C=CN=CC3=C(C=C2)N

InChI

InChI=1S/C17H17N3/c1-12-2-4-13(5-3-12)10-20-17-7-6-16(18)15-11-19-9-8-14(15)17/h2-9,11,20H,10,18H2,1H3