(1S,3S,4R)-4-[(4R,7aR)-4-(2-azanylethyl)-7a-methyl-1-methylidene-3,3a,4,5,6,7-hexahydro-2H-inden-5-yl]-4-methyl-cyclohexane-1,3-diol

Systemtic Name: (1S,3S,4R)-4-[(4R,7aR)-4-(2-azanylethyl)-7a-methyl-1-methylidene-3,3a,4,5,6,7-hexahydro-2H-inden-5-yl]-4-methyl-cyclohexane-1,3-diol Openeye Name: (1S,3S,4R)-4-[(4R,7aR)-4-(2-aminoethyl)-7a-methyl-1-methylene-3,3a,4,5,6,7-hexahydro-2H-inden-5-yl]-4-methyl-cyclohexane-1,3-diol CAS Name: (1S,3S,4R)-4-[(4R,7aR)-4-(2-aminoethyl)-7a-methyl-1-methylene-3,3a,4,5,6,7-hexahydro-2H-inden-5-yl]-4-methylcyclohexane-1,3-diol IUPAC Name: (1S,3S,4R)-4-[(4R,7aR)-4-(2-aminoethyl)-7a-methyl-1-methylidene-3,3a,4,5,6,7-hexahydro-2H-inden-5-yl]-4-methylcyclohexane-1,3-diol Traditional Name: (1S,3S,4R)-4-[(4R,7aR)-4-(2-aminoethyl)-7a-methyl-1-methylene-3,3a,4,5,6,7-hexahydro-2H-inden-5-yl]-4-methyl-cyclohexane-1,3-diol Formula: C20H35NO2 MolecularWeight: 321.4974

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(CCC(CC1O)O)C2CCC3(C(C2CCN)CCC3=C)C

Isomeric SMILES

C[C@@]1(CC[C@@H](C[C@@H]1O)O)C2CC[C@@]3(C([C@H]2CCN)CCC3=C)C

InChI

InChI=1S/C20H35NO2/c1-13-4-5-16-15(8-11-21)17(7-10-19(13,16)2)20(3)9-6-14(22)12-18(20)23/h14-18,22-23H,1,4-12,21H2,2-3H3/t14-,15+,16?,17?,18-,19-,20+/m0/s1