3-[4-(4-chlorophenyl)-1,3-dihydroisochromen-4-yl]-N-(phenylmethyl)propan-1-amine

Systemtic Name: 3-[4-(4-chlorophenyl)-1,3-dihydroisochromen-4-yl]-N-(phenylmethyl)propan-1-amine Openeye Name: N-benzyl-3-[4-(4-chlorophenyl)isochroman-4-yl]propan-1-amine CAS Name: 3-[4-(4-chlorophenyl)-3,4-dihydro-1H-2-benzopyran-4-yl]-N-(phenylmethyl)-1-propanamine IUPAC Name: N-benzyl-3-[4-(4-chlorophenyl)-1,3-dihydroisochromen-4-yl]propan-1-amine Traditional Name: benzyl-[3-[4-(4-chlorophenyl)isochroman-4-yl]propyl]amine Formula: C25H26ClNO MolecularWeight: 391.93304

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=CC=CC=C2C(CO1)(CCCNCC3=CC=CC=C3)C4=CC=C(C=C4)Cl

Isomeric SMILES

C1C2=CC=CC=C2C(CO1)(CCCNCC3=CC=CC=C3)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C25H26ClNO/c26-23-13-11-22(12-14-23)25(19-28-18-21-9-4-5-10-24(21)25)15-6-16-27-17-20-7-2-1-3-8-20/h1-5,7-14,27H,6,15-19H2