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

Systemtic Name: 1-(1-ethyl-7-oxidanylidene-2-propyl-1,5,6,9,10,10a-hexahydrophenanthren-2-yl)ethyl ethanoate Openeye Name: 1-(1-ethyl-7-oxo-2-propyl-1,5,6,9,10,10a-hexahydrophenanthren-2-yl)ethyl acetate CAS Name: acetic acid 1-(1-ethyl-7-oxo-2-propyl-1,5,6,9,10,10a-hexahydrophenanthren-2-yl)ethyl ester IUPAC Name: 1-(1-ethyl-7-oxo-2-propyl-1,5,6,9,10,10a-hexahydrophenanthren-2-yl)ethyl acetate Traditional Name: acetic acid 1-(1-ethyl-7-keto-2-propyl-1,5,6,9,10,10a-hexahydrophenanthren-2-yl)ethyl ester Formula: C23H32O3 MolecularWeight: 356.49838

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1(C=CC2=C3CCC(=O)C=C3CCC2C1CC)C(C)OC(=O)C

Isomeric SMILES

CCCC1(C=CC2=C3CCC(=O)C=C3CCC2C1CC)C(C)OC(=O)C

InChI

InChI=1S/C23H32O3/c1-5-12-23(15(3)26-16(4)24)13-11-20-19-10-8-18(25)14-17(19)7-9-21(20)22(23)6-2/h11,13-15,21-22H,5-10,12H2,1-4H3