3-[1-hexyl-3-(2-methylpropyl)pyrrolidin-3-yl]phenol

Systemtic Name: 3-[1-hexyl-3-(2-methylpropyl)pyrrolidin-3-yl]phenol Openeye Name: 3-(1-hexyl-3-isobutyl-pyrrolidin-3-yl)phenol CAS Name: 3-[1-hexyl-3-(2-methylpropyl)-3-pyrrolidinyl]phenol IUPAC Name: 3-[1-hexyl-3-(2-methylpropyl)pyrrolidin-3-yl]phenol Traditional Name: 3-(1-hexyl-3-isobutyl-pyrrolidin-3-yl)phenol Formula: C20H33NO MolecularWeight: 303.48212

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN1CCC(C1)(CC(C)C)C2=CC(=CC=C2)O

Isomeric SMILES

CCCCCCN1CCC(C1)(CC(C)C)C2=CC(=CC=C2)O

InChI

InChI=1S/C20H33NO/c1-4-5-6-7-12-21-13-11-20(16-21,15-17(2)3)18-9-8-10-19(22)14-18/h8-10,14,17,22H,4-7,11-13,15-16H2,1-3H3