[4-[2-(hydroxymethyl)-5-oxidanylidene-4-propan-2-yl-pyrrolidin-3-yl]-6,6-dimethyl-7,8-dihydro-5H-naphthalen-1-yl] nonanoate

Systemtic Name: [4-[2-(hydroxymethyl)-5-oxidanylidene-4-propan-2-yl-pyrrolidin-3-yl]-6,6-dimethyl-7,8-dihydro-5H-naphthalen-1-yl] nonanoate Openeye Name: [8-[2-(hydroxymethyl)-4-isopropyl-5-oxo-pyrrolidin-3-yl]-2,2-dimethyl-tetralin-5-yl] nonanoate CAS Name: nonanoic acid [4-[2-(hydroxymethyl)-5-oxo-4-propan-2-yl-3-pyrrolidinyl]-6,6-dimethyl-7,8-dihydro-5H-naphthalen-1-yl] ester IUPAC Name: [4-[2-(hydroxymethyl)-5-oxo-4-propan-2-ylpyrrolidin-3-yl]-6,6-dimethyl-7,8-dihydro-5H-naphthalen-1-yl] nonanoate Traditional Name: pelargonic acid [8-(4-isopropyl-5-keto-2-methylol-pyrrolidin-3-yl)-2,2-dimethyl-tetralin-5-yl] ester Formula: C29H45NO4 MolecularWeight: 471.6719

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC(=O)OC1=C2CCC(CC2=C(C=C1)C3C(NC(=O)C3C(C)C)CO)(C)C

Isomeric SMILES

CCCCCCCCC(=O)OC1=C2CCC(CC2=C(C=C1)C3C(NC(=O)C3C(C)C)CO)(C)C

InChI

InChI=1S/C29H45NO4/c1-6-7-8-9-10-11-12-25(32)34-24-14-13-21(22-17-29(4,5)16-15-20(22)24)27-23(18-31)30-28(33)26(27)19(2)3/h13-14,19,23,26-27,31H,6-12,15-18H2,1-5H3,(H,30,33)