(1S)-N-butyl-1-[3-[3-(dimethylamino)propoxy]phenyl]-N-ethyl-ethane-1,2-diamine

Systemtic Name: (1S)-N-butyl-1-[3-[3-(dimethylamino)propoxy]phenyl]-N-ethyl-ethane-1,2-diamine Openeye Name: (1S)-N-butyl-1-[3-[3-(dimethylamino)propoxy]phenyl]-N-ethyl-ethane-1,2-diamine CAS Name: (1S)-N-butyl-1-[3-[3-(dimethylamino)propoxy]phenyl]-N-ethylethane-1,2-diamine IUPAC Name: (1S)-N-butyl-1-[3-[3-(dimethylamino)propoxy]phenyl]-N-ethylethane-1,2-diamine Traditional Name: 3-[3-[(1S)-2-amino-1-[butyl(ethyl)amino]ethyl]phenoxy]propyl-dimethyl-amine Formula: C19H35N3O MolecularWeight: 321.5007

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CC)C(CN)C1=CC(=CC=C1)OCCCN(C)C

Isomeric SMILES

CCCCN(CC)[C@H](CN)C1=CC(=CC=C1)OCCCN(C)C

InChI

InChI=1S/C19H35N3O/c1-5-7-13-22(6-2)19(16-20)17-10-8-11-18(15-17)23-14-9-12-21(3)4/h8,10-11,15,19H,5-7,9,12-14,16,20H2,1-4H3/t19-/m1/s1