2-azanyl-2-methyl-propane-1,3-diol; 7-ethenyl-1,4a,7-trimethyl-3,4,4b,5,6,8,10,10a-octahydro-2H-phenanthrene-1-carboxylic acid

Systemtic Name: 2-azanyl-2-methyl-propane-1,3-diol; 7-ethenyl-1,4a,7-trimethyl-3,4,4b,5,6,8,10,10a-octahydro-2H-phenanthrene-1-carboxylic acid Openeye Name: 2-amino-2-methyl-propane-1,3-diol; 1,4a,7-trimethyl-7-vinyl-3,4,4b,5,6,8,10,10a-octahydro-2H-phenanthrene-1-carboxylic acid CAS Name: 2-amino-2-methylpropane-1,3-diol; 7-ethenyl-1,4a,7-trimethyl-3,4,4b,5,6,8,10,10a-octahydro-2H-phenanthrene-1-carboxylic acid IUPAC Name: 2-amino-2-methylpropane-1,3-diol; 7-ethenyl-1,4a,7-trimethyl-3,4,4b,5,6,8,10,10a-octahydro-2H-phenanthrene-1-carboxylic acid Traditional Name: 2-amino-2-methyl-propane-1,3-diol; 1,4a,7-trimethyl-7-vinyl-3,4,4b,5,6,8,10,10a-octahydro-2H-phenanthrene-1-carboxylic acid Formula: C24H41NO4 MolecularWeight: 407.58664

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CCC2C(=CCC3C2(CCCC3(C)C(=O)O)C)C1)C=C.CC(CO)(CO)N

Isomeric SMILES

CC1(CCC2C(=CCC3C2(CCCC3(C)C(=O)O)C)C1)C=C.CC(CO)(CO)N

InChI

InChI=1S/C20H30O2.C4H11NO2/c1-5-18(2)12-9-15-14(13-18)7-8-16-19(15,3)10-6-11-20(16,4)17(21)22;1-4(5,2-6)3-7/h5,7,15-16H,1,6,8-13H2,2-4H3,(H,21,22);6-7H,2-3,5H2,1H3