8-[2-(butylamino)ethyl]-3,5-dimethoxy-phenanthrene-2,6-diol

Systemtic Name: 8-[2-(butylamino)ethyl]-3,5-dimethoxy-phenanthrene-2,6-diol Openeye Name: 8-[2-(butylamino)ethyl]-3,5-dimethoxy-phenanthrene-2,6-diol CAS Name: 8-[2-(butylamino)ethyl]-3,5-dimethoxyphenanthrene-2,6-diol IUPAC Name: 8-[2-(butylamino)ethyl]-3,5-dimethoxyphenanthrene-2,6-diol Traditional Name: 8-[2-(butylamino)ethyl]-3,5-dimethoxy-phenanthrene-2,6-diol Formula: C22H27NO4 MolecularWeight: 369.45408

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNCCC1=CC(=C(C2=C1C=CC3=CC(=C(C=C32)OC)O)OC)O

Isomeric SMILES

CCCCNCCC1=CC(=C(C2=C1C=CC3=CC(=C(C=C32)OC)O)OC)O

InChI

InChI=1S/C22H27NO4/c1-4-5-9-23-10-8-15-12-19(25)22(27-3)21-16(15)7-6-14-11-18(24)20(26-2)13-17(14)21/h6-7,11-13,23-25H,4-5,8-10H2,1-3H3