N7-(phenylmethyl)isoquinoline-1,7-diamine dihydrochloride

Systemtic Name: N7-(phenylmethyl)isoquinoline-1,7-diamine dihydrochloride Openeye Name: N7-benzylisoquinoline-1,7-diamine dihydrochloride CAS Name: N7-(phenylmethyl)isoquinoline-1,7-diamine dihydrochloride IUPAC Name: 7-N-benzylisoquinoline-1,7-diamine dihydrochloride Traditional Name: (1-amino-7-isoquinolyl)-benzyl-amine dihydrochloride Formula: C16H17Cl2N3 MolecularWeight: 322.23228

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC2=CC3=C(C=C2)C=CN=C3N.Cl.Cl

Isomeric SMILES

C1=CC=C(C=C1)CNC2=CC3=C(C=C2)C=CN=C3N.Cl.Cl

InChI

InChI=1S/C16H15N3.2ClH/c17-16-15-10-14(7-6-13(15)8-9-18-16)19-11-12-4-2-1-3-5-12;;/h1-10,19H,11H2,(H2,17,18);2*1H