4-(2-phenoxyethylamino)-1-(phenylmethyl)piperidin-4-ol; propan-2-ol; titanium

Systemtic Name: 4-(2-phenoxyethylamino)-1-(phenylmethyl)piperidin-4-ol; propan-2-ol; titanium Openeye Name: 1-benzyl-4-(2-phenoxyethylamino)piperidin-4-ol; propan-2-ol; titanium CAS Name: 4-(2-phenoxyethylamino)-1-(phenylmethyl)-4-piperidinol; 2-propanol; titanium IUPAC Name: 1-benzyl-4-(2-phenoxyethylamino)piperidin-4-ol; propan-2-ol; titanium Traditional Name: 1-benzyl-4-(2-phenoxyethylamino)piperidin-4-ol; propan-2-ol; titanium Formula: C29H50N2O5Ti MolecularWeight: 554.5847

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)O.CC(C)O.CC(C)O.C1CN(CCC1(NCCOC2=CC=CC=C2)O)CC3=CC=CC=C3.[Ti]

Isomeric SMILES

CC(C)O.CC(C)O.CC(C)O.C1CN(CCC1(NCCOC2=CC=CC=C2)O)CC3=CC=CC=C3.[Ti]

InChI

InChI=1S/C20H26N2O2.3C3H8O.Ti/c23-20(21-13-16-24-19-9-5-2-6-10-19)11-14-22(15-12-20)17-18-7-3-1-4-8-18;3*1-3(2)4;/h1-10,21,23H,11-17H2;3*3-4H,1-2H3;