7-decoxy-2-heptoxy-9,10-dihydrophenanthren-1-amine

Systemtic Name: 7-decoxy-2-heptoxy-9,10-dihydrophenanthren-1-amine Openeye Name: 7-decoxy-2-heptoxy-9,10-dihydrophenanthren-1-amine CAS Name: 7-decoxy-2-heptoxy-9,10-dihydrophenanthren-1-amine IUPAC Name: 7-decoxy-2-heptoxy-9,10-dihydrophenanthren-1-amine Traditional Name: (7-decoxy-2-heptoxy-9,10-dihydrophenanthren-1-yl)amine Formula: C31H47NO2 MolecularWeight: 465.71038

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCOC1=CC2=C(C=C1)C3=C(CC2)C(=C(C=C3)OCCCCCCC)N

Isomeric SMILES

CCCCCCCCCCOC1=CC2=C(C=C1)C3=C(CC2)C(=C(C=C3)OCCCCCCC)N

InChI

InChI=1S/C31H47NO2/c1-3-5-7-9-10-11-13-14-22-33-26-17-19-27-25(24-26)16-18-29-28(27)20-21-30(31(29)32)34-23-15-12-8-6-4-2/h17,19-21,24H,3-16,18,22-23,32H2,1-2H3