4-butyl-2-[1-phenyl-3-(propan-2-ylamino)propyl]phenol hydrochloride

Systemtic Name: 4-butyl-2-[1-phenyl-3-(propan-2-ylamino)propyl]phenol hydrochloride Openeye Name: 4-butyl-2-[3-(isopropylamino)-1-phenyl-propyl]phenol hydrochloride CAS Name: 4-butyl-2-[1-phenyl-3-(propan-2-ylamino)propyl]phenol hydrochloride IUPAC Name: 4-butyl-2-[1-phenyl-3-(propan-2-ylamino)propyl]phenol hydrochloride Traditional Name: 4-butyl-2-[3-(isopropylamino)-1-phenyl-propyl]phenol hydrochloride Formula: C22H32ClNO MolecularWeight: 361.94858

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC(=C(C=C1)O)C(CCNC(C)C)C2=CC=CC=C2.Cl

Isomeric SMILES

CCCCC1=CC(=C(C=C1)O)C(CCNC(C)C)C2=CC=CC=C2.Cl

InChI

InChI=1S/C22H31NO.ClH/c1-4-5-9-18-12-13-22(24)21(16-18)20(14-15-23-17(2)3)19-10-7-6-8-11-19;/h6-8,10-13,16-17,20,23-24H,4-5,9,14-15H2,1-3H3;1H