[6-(3-pentanoyloxyphenyl)-5-[4-(2-pyrrolidin-1-ylethoxy)phenyl]carbonyl-7,8-dihydronaphthalen-2-yl] pentanoate

Systemtic Name: [6-(3-pentanoyloxyphenyl)-5-[4-(2-pyrrolidin-1-ylethoxy)phenyl]carbonyl-7,8-dihydronaphthalen-2-yl] pentanoate Openeye Name: [6-(3-pentanoyloxyphenyl)-5-[4-(2-pyrrolidin-1-ylethoxy)benzoyl]-7,8-dihydronaphthalen-2-yl] pentanoate CAS Name: pentanoic acid [6-[3-(1-oxopentoxy)phenyl]-5-[oxo-[4-[2-(1-pyrrolidinyl)ethoxy]phenyl]methyl]-7,8-dihydronaphthalen-2-yl] ester IUPAC Name: [6-(3-pentanoyloxyphenyl)-5-[4-(2-pyrrolidin-1-ylethoxy)benzoyl]-7,8-dihydronaphthalen-2-yl] pentanoate Traditional Name: valeric acid [5-[4-(2-pyrrolidinoethoxy)benzoyl]-6-(3-valeryloxyphenyl)-7,8-dihydronaphthalen-2-yl] ester Formula: C39H45NO6 MolecularWeight: 623.7777

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)OC1=CC2=C(C=C1)C(=C(CC2)C3=CC(=CC=C3)OC(=O)CCCC)C(=O)C4=CC=C(C=C4)OCCN5CCCC5

Isomeric SMILES

CCCCC(=O)OC1=CC2=C(C=C1)C(=C(CC2)C3=CC(=CC=C3)OC(=O)CCCC)C(=O)C4=CC=C(C=C4)OCCN5CCCC5

InChI

InChI=1S/C39H45NO6/c1-3-5-12-36(41)45-32-11-9-10-29(26-32)34-20-16-30-27-33(46-37(42)13-6-4-2)19-21-35(30)38(34)39(43)28-14-17-31(18-15-28)44-25-24-40-22-7-8-23-40/h9-11,14-15,17-19,21,26-27H,3-8,12-13,16,20,22-25H2,1-2H3