5-[bis(2-methylpropyl)amino]-2-[(phenylmethyl)amino]pent-3-yn-1-ol

Systemtic Name: 5-[bis(2-methylpropyl)amino]-2-[(phenylmethyl)amino]pent-3-yn-1-ol Openeye Name: 2-(benzylamino)-5-(diisobutylamino)pent-3-yn-1-ol CAS Name: 5-[bis(2-methylpropyl)amino]-2-[(phenylmethyl)amino]-3-pentyn-1-ol IUPAC Name: 2-(benzylamino)-5-[bis(2-methylpropyl)amino]pent-3-yn-1-ol Traditional Name: 2-(benzylamino)-5-(diisobutylamino)pent-3-yn-1-ol Formula: C20H32N2O MolecularWeight: 316.48088

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN(CC#CC(CO)NCC1=CC=CC=C1)CC(C)C

Isomeric SMILES

CC(C)CN(CC#CC(CO)NCC1=CC=CC=C1)CC(C)C

InChI

InChI=1S/C20H32N2O/c1-17(2)14-22(15-18(3)4)12-8-11-20(16-23)21-13-19-9-6-5-7-10-19/h5-7,9-10,17-18,20-21,23H,12-16H2,1-4H3