4-[2-[[(1R,4aS,10aR)-1,4a-dimethyl-7-propan-2-yl-2,3,4,9,10,10a-hexahydrophenanthren-1-yl]methylamino]ethylamino]butan-1-ol

Systemtic Name: 4-[2-[[(1R,4aS,10aR)-1,4a-dimethyl-7-propan-2-yl-2,3,4,9,10,10a-hexahydrophenanthren-1-yl]methylamino]ethylamino]butan-1-ol Openeye Name: 4-[2-[[(1R,4aS,10aR)-7-isopropyl-1,4a-dimethyl-2,3,4,9,10,10a-hexahydrophenanthren-1-yl]methylamino]ethylamino]butan-1-ol CAS Name: 4-[2-[[(1R,4aS,10aR)-1,4a-dimethyl-7-propan-2-yl-2,3,4,9,10,10a-hexahydrophenanthren-1-yl]methylamino]ethylamino]-1-butanol IUPAC Name: 4-[2-[[(1R,4aS,10aR)-1,4a-dimethyl-7-propan-2-yl-2,3,4,9,10,10a-hexahydrophenanthren-1-yl]methylamino]ethylamino]butan-1-ol Traditional Name: 4-[2-[[(1R,4aS,10aR)-7-isopropyl-1,4a-dimethyl-2,3,4,9,10,10a-hexahydrophenanthren-1-yl]methylamino]ethylamino]butan-1-ol Formula: C26H44N2O MolecularWeight: 400.64036

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC2=C(C=C1)C3(CCCC(C3CC2)(C)CNCCNCCCCO)C

Isomeric SMILES

CC(C)C1=CC2=C(C=C1)[C@]3(CCC[C@@]([C@@H]3CC2)(C)CNCCNCCCCO)C

InChI

InChI=1S/C26H44N2O/c1-20(2)21-8-10-23-22(18-21)9-11-24-25(3,12-7-13-26(23,24)4)19-28-16-15-27-14-5-6-17-29/h8,10,18,20,24,27-29H,5-7,9,11-17,19H2,1-4H3/t24-,25-,26+/m0/s1