nonyl 3-(4-propan-2-yloxyphenyl)carbonyl-5,6,7,8-tetrahydroindolizine-8-carboxylate

Systemtic Name: nonyl 3-(4-propan-2-yloxyphenyl)carbonyl-5,6,7,8-tetrahydroindolizine-8-carboxylate Openeye Name: nonyl 3-(4-isopropoxybenzoyl)-5,6,7,8-tetrahydroindolizine-8-carboxylate CAS Name: 3-[oxo-(4-propan-2-yloxyphenyl)methyl]-5,6,7,8-tetrahydroindolizine-8-carboxylic acid nonyl ester IUPAC Name: nonyl 3-(4-propan-2-yloxybenzoyl)-5,6,7,8-tetrahydroindolizine-8-carboxylate Traditional Name: 3-(4-isopropoxybenzoyl)-5,6,7,8-tetrahydroindolizine-8-carboxylic acid nonyl ester Formula: C28H39NO4 MolecularWeight: 453.61356

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCOC(=O)C1CCCN2C1=CC=C2C(=O)C3=CC=C(C=C3)OC(C)C

Isomeric SMILES

CCCCCCCCCOC(=O)C1CCCN2C1=CC=C2C(=O)C3=CC=C(C=C3)OC(C)C

InChI

InChI=1S/C28H39NO4/c1-4-5-6-7-8-9-10-20-32-28(31)24-12-11-19-29-25(24)17-18-26(29)27(30)22-13-15-23(16-14-22)33-21(2)3/h13-18,21,24H,4-12,19-20H2,1-3H3