ethyl 8a-methyl-5-oxidanylidene-2-pyrrolidin-1-yl-4b,6,7,8,9,10-hexahydrophenanthrene-3-carboxylate

Systemtic Name: ethyl 8a-methyl-5-oxidanylidene-2-pyrrolidin-1-yl-4b,6,7,8,9,10-hexahydrophenanthrene-3-carboxylate Openeye Name: ethyl 8a-methyl-5-oxo-2-pyrrolidin-1-yl-4b,6,7,8,9,10-hexahydrophenanthrene-3-carboxylate CAS Name: 8a-methyl-5-oxo-2-(1-pyrrolidinyl)-4b,6,7,8,9,10-hexahydrophenanthrene-3-carboxylic acid ethyl ester IUPAC Name: ethyl 8a-methyl-5-oxo-2-pyrrolidin-1-yl-4b,6,7,8,9,10-hexahydrophenanthrene-3-carboxylate Traditional Name: 5-keto-8a-methyl-2-pyrrolidino-4b,6,7,8,9,10-hexahydrophenanthrene-3-carboxylic acid ethyl ester Formula: C22H29NO3 MolecularWeight: 355.47056

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC2=C(CCC3(C2C(=O)CCC3)C)C=C1N4CCCC4

Isomeric SMILES

CCOC(=O)C1=CC2=C(CCC3(C2C(=O)CCC3)C)C=C1N4CCCC4

InChI

InChI=1S/C22H29NO3/c1-3-26-21(25)17-14-16-15(13-18(17)23-11-4-5-12-23)8-10-22(2)9-6-7-19(24)20(16)22/h13-14,20H,3-12H2,1-2H3