butan-1-amine; (phenylmethyl)benzene; dihydrochloride

Systemtic Name: butan-1-amine; (phenylmethyl)benzene; dihydrochloride Openeye Name: benzylbenzene; butan-1-amine; dihydrochloride CAS Name: 1-butanamine; (phenylmethyl)benzene; dihydrochloride IUPAC Name: benzylbenzene; butan-1-amine; dihydrochloride Traditional Name: benzylbenzene; butylamine; dihydrochloride Formula: C17H25Cl2N MolecularWeight: 314.2931

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN.C1=CC=C(C=C1)CC2=CC=CC=C2.Cl.Cl

Isomeric SMILES

CCCCN.C1=CC=C(C=C1)CC2=CC=CC=C2.Cl.Cl

InChI

InChI=1S/C13H12.C4H11N.2ClH/c1-3-7-12(8-4-1)11-13-9-5-2-6-10-13;1-2-3-4-5;;/h1-10H,11H2;2-5H2,1H3;2*1H