(6,6,9-trimethyl-3-pentyl-6a,7,10,10a-tetrahydrobenzo[c]chromen-1-yl) 3-pyrrolidin-1-ylpropanoate

Systemtic Name: (6,6,9-trimethyl-3-pentyl-6a,7,10,10a-tetrahydrobenzo[c]chromen-1-yl) 3-pyrrolidin-1-ylpropanoate Openeye Name: (6,6,9-trimethyl-3-pentyl-6a,7,10,10a-tetrahydrobenzo[c]chromen-1-yl) 3-pyrrolidin-1-ylpropanoate CAS Name: 3-(1-pyrrolidinyl)propanoic acid (6,6,9-trimethyl-3-pentyl-6a,7,10,10a-tetrahydrobenzo[c][1]benzopyran-1-yl) ester IUPAC Name: (6,6,9-trimethyl-3-pentyl-6a,7,10,10a-tetrahydrobenzo[c]chromen-1-yl) 3-pyrrolidin-1-ylpropanoate Traditional Name: 3-pyrrolidinopropionic acid (3-amyl-6,6,9-trimethyl-6a,7,10,10a-tetrahydrobenzo[c]chromen-1-yl) ester Formula: C28H41NO3 MolecularWeight: 439.63004

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC2=C(C3CC(=CCC3C(O2)(C)C)C)C(=C1)OC(=O)CCN4CCCC4

Isomeric SMILES

CCCCCC1=CC2=C(C3CC(=CCC3C(O2)(C)C)C)C(=C1)OC(=O)CCN4CCCC4

InChI

InChI=1S/C28H41NO3/c1-5-6-7-10-21-18-24(31-26(30)13-16-29-14-8-9-15-29)27-22-17-20(2)11-12-23(22)28(3,4)32-25(27)19-21/h11,18-19,22-23H,5-10,12-17H2,1-4H3