N-[(3,6,7-trimethoxyphenanthren-9-yl)methyl]propan-1-amine hydrochloride

Systemtic Name: N-[(3,6,7-trimethoxyphenanthren-9-yl)methyl]propan-1-amine hydrochloride Openeye Name: N-[(3,6,7-trimethoxy-9-phenanthryl)methyl]propan-1-amine hydrochloride CAS Name: N-[(3,6,7-trimethoxy-9-phenanthrenyl)methyl]-1-propanamine hydrochloride IUPAC Name: N-[(3,6,7-trimethoxyphenanthren-9-yl)methyl]propan-1-amine hydrochloride Traditional Name: propyl-[(3,6,7-trimethoxy-9-phenanthryl)methyl]amine hydrochloride Formula: C21H26ClNO3 MolecularWeight: 375.88904

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Descriptors Computed from Structure

Canonical SMILES:

CCCNCC1=C2C=C(C(=CC2=C3C=C(C=CC3=C1)OC)OC)OC.Cl

Isomeric SMILES

CCCNCC1=C2C=C(C(=CC2=C3C=C(C=CC3=C1)OC)OC)OC.Cl

InChI

InChI=1S/C21H25NO3.ClH/c1-5-8-22-13-15-9-14-6-7-16(23-2)10-17(14)19-12-21(25-4)20(24-3)11-18(15)19;/h6-7,9-12,22H,5,8,13H2,1-4H3;1H