6-(4-hydroxyphenyl)-5-[(4-propoxyphenyl)methyl]naphthalen-2-ol; propan-2-amine

Systemtic Name: 6-(4-hydroxyphenyl)-5-[(4-propoxyphenyl)methyl]naphthalen-2-ol; propan-2-amine Openeye Name: 6-(4-hydroxyphenyl)-5-[(4-propoxyphenyl)methyl]naphthalen-2-ol; propan-2-amine CAS Name: 6-(4-hydroxyphenyl)-5-[(4-propoxyphenyl)methyl]-2-naphthalenol; 2-propanamine IUPAC Name: 6-(4-hydroxyphenyl)-5-[(4-propoxyphenyl)methyl]naphthalen-2-ol; propan-2-amine Traditional Name: 6-(4-hydroxyphenyl)-5-(4-propoxybenzyl)-2-naphthol; isopropylamine Formula: C29H33NO3 MolecularWeight: 443.57722

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)CC2=C(C=CC3=C2C=CC(=C3)O)C4=CC=C(C=C4)O.CC(C)N

Isomeric SMILES

CCCOC1=CC=C(C=C1)CC2=C(C=CC3=C2C=CC(=C3)O)C4=CC=C(C=C4)O.CC(C)N

InChI

InChI=1S/C26H24O3.C3H9N/c1-2-15-29-23-11-3-18(4-12-23)16-26-24(19-5-8-21(27)9-6-19)13-7-20-17-22(28)10-14-25(20)26;1-3(2)4/h3-14,17,27-28H,2,15-16H2,1H3;3H,4H2,1-2H3