4b-[2-(phenethylamino)ethyl]-6,7,8,8a,9,10-hexahydro-5H-phenanthrene-1,2-diol

Systemtic Name: 4b-[2-(phenethylamino)ethyl]-6,7,8,8a,9,10-hexahydro-5H-phenanthrene-1,2-diol Openeye Name: 4b-[2-(phenethylamino)ethyl]-6,7,8,8a,9,10-hexahydro-5H-phenanthrene-1,2-diol CAS Name: 4b-[2-(phenethylamino)ethyl]-6,7,8,8a,9,10-hexahydro-5H-phenanthrene-1,2-diol IUPAC Name: 4b-[2-(phenethylamino)ethyl]-6,7,8,8a,9,10-hexahydro-5H-phenanthrene-1,2-diol Traditional Name: 4b-[2-(phenethylamino)ethyl]-6,7,8,8a,9,10-hexahydro-5H-phenanthrene-1,2-diol Formula: C24H31NO2 MolecularWeight: 365.50844

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2(C(C1)CCC3=C2C=CC(=C3O)O)CCNCCC4=CC=CC=C4

Isomeric SMILES

C1CCC2(C(C1)CCC3=C2C=CC(=C3O)O)CCNCCC4=CC=CC=C4

InChI

InChI=1S/C24H31NO2/c26-22-12-11-21-20(23(22)27)10-9-19-8-4-5-14-24(19,21)15-17-25-16-13-18-6-2-1-3-7-18/h1-3,6-7,11-12,19,25-27H,4-5,8-10,13-17H2