N-phenethyl-3-(4-phenyl-1,3-dihydroisochromen-4-yl)propan-1-amine hydrochloride

Systemtic Name: N-phenethyl-3-(4-phenyl-1,3-dihydroisochromen-4-yl)propan-1-amine hydrochloride Openeye Name: N-phenethyl-3-(4-phenylisochroman-4-yl)propan-1-amine hydrochloride CAS Name: N-phenethyl-3-(4-phenyl-3,4-dihydro-1H-2-benzopyran-4-yl)-1-propanamine hydrochloride IUPAC Name: N-phenethyl-3-(4-phenyl-1,3-dihydroisochromen-4-yl)propan-1-amine hydrochloride Traditional Name: phenethyl-[3-(4-phenylisochroman-4-yl)propyl]amine hydrochloride Formula: C26H30ClNO MolecularWeight: 407.9755

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=CC=CC=C2C(CO1)(CCCNCCC3=CC=CC=C3)C4=CC=CC=C4.Cl

Isomeric SMILES

C1C2=CC=CC=C2C(CO1)(CCCNCCC3=CC=CC=C3)C4=CC=CC=C4.Cl

InChI

InChI=1S/C26H29NO.ClH/c1-3-10-22(11-4-1)16-19-27-18-9-17-26(24-13-5-2-6-14-24)21-28-20-23-12-7-8-15-25(23)26;/h1-8,10-15,27H,9,16-21H2;1H