(1,2-diethyl-7-oxidanylidene-1,5,6,9,10,10a-hexahydrophenanthren-2-yl)methyl ethanoate

Systemtic Name: (1,2-diethyl-7-oxidanylidene-1,5,6,9,10,10a-hexahydrophenanthren-2-yl)methyl ethanoate Openeye Name: (1,2-diethyl-7-oxo-1,5,6,9,10,10a-hexahydrophenanthren-2-yl)methyl acetate CAS Name: acetic acid (1,2-diethyl-7-oxo-1,5,6,9,10,10a-hexahydrophenanthren-2-yl)methyl ester IUPAC Name: (1,2-diethyl-7-oxo-1,5,6,9,10,10a-hexahydrophenanthren-2-yl)methyl acetate Traditional Name: acetic acid (1,2-diethyl-7-keto-1,5,6,9,10,10a-hexahydrophenanthren-2-yl)methyl ester Formula: C21H28O3 MolecularWeight: 328.44522

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Descriptors Computed from Structure

Canonical SMILES:

CCC1C2CCC3=CC(=O)CCC3=C2C=CC1(CC)COC(=O)C

Isomeric SMILES

CCC1C2CCC3=CC(=O)CCC3=C2C=CC1(CC)COC(=O)C

InChI

InChI=1S/C21H28O3/c1-4-20-19-8-6-15-12-16(23)7-9-17(15)18(19)10-11-21(20,5-2)13-24-14(3)22/h10-12,19-20H,4-9,13H2,1-3H3