(5,5-dimethyl-2-phenethyl-8-tetradecan-2-yl-3,4-dihydro-1H-chromeno[4,3-c]pyridin-10-yl) 4-pyrrolidin-1-ylbutanoate

Systemtic Name: (5,5-dimethyl-2-phenethyl-8-tetradecan-2-yl-3,4-dihydro-1H-chromeno[4,3-c]pyridin-10-yl) 4-pyrrolidin-1-ylbutanoate Openeye Name: [5,5-dimethyl-8-(1-methyltridecyl)-2-phenethyl-3,4-dihydro-1H-chromeno[4,3-c]pyridin-10-yl] 4-pyrrolidin-1-ylbutanoate CAS Name: 4-(1-pyrrolidinyl)butanoic acid (5,5-dimethyl-2-phenethyl-8-tetradecan-2-yl-3,4-dihydro-1H-[1]benzopyrano[4,3-c]pyridin-10-yl) ester IUPAC Name: (5,5-dimethyl-2-phenethyl-8-tetradecan-2-yl-3,4-dihydro-1H-chromeno[4,3-c]pyridin-10-yl) 4-pyrrolidin-1-ylbutanoate Traditional Name: 4-pyrrolidinobutyric acid [5,5-dimethyl-8-(1-methyltridecyl)-2-phenethyl-3,4-dihydro-1H-chromeno[4,3-c]pyridin-10-yl] ester Formula: C44H66N2O3 MolecularWeight: 671.00644

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC(C)C1=CC2=C(C3=C(CCN(C3)CCC4=CC=CC=C4)C(O2)(C)C)C(=C1)OC(=O)CCCN5CCCC5

Isomeric SMILES

CCCCCCCCCCCCC(C)C1=CC2=C(C3=C(CCN(C3)CCC4=CC=CC=C4)C(O2)(C)C)C(=C1)OC(=O)CCCN5CCCC5

InChI

InChI=1S/C44H66N2O3/c1-5-6-7-8-9-10-11-12-13-15-21-35(2)37-32-40(48-42(47)24-20-29-45-27-18-19-28-45)43-38-34-46(30-25-36-22-16-14-17-23-36)31-26-39(38)44(3,4)49-41(43)33-37/h14,16-17,22-23,32-33,35H,5-13,15,18-21,24-31,34H2,1-4H3