4-tert-butylbenzoic acid; 1-carbazol-9-yl-3-[2-hydroxyethyl(methyl)amino]propan-2-ol

Systemtic Name: 4-tert-butylbenzoic acid; 1-carbazol-9-yl-3-[2-hydroxyethyl(methyl)amino]propan-2-ol Openeye Name: 4-tert-butylbenzoic acid; 1-carbazol-9-yl-3-[2-hydroxyethyl(methyl)amino]propan-2-ol CAS Name: 4-tert-butylbenzoic acid; 1-(9-carbazolyl)-3-[2-hydroxyethyl(methyl)amino]-2-propanol IUPAC Name: 4-tert-butylbenzoic acid; 1-carbazol-9-yl-3-[2-hydroxyethyl(methyl)amino]propan-2-ol Traditional Name: 4-tert-butylbenzoic acid; 1-carbazol-9-yl-3-[2-hydroxyethyl(methyl)amino]propan-2-ol Formula: C29H36N2O4 MolecularWeight: 476.60714

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=O)O.CN(CCO)CC(CN1C2=CC=CC=C2C3=CC=CC=C31)O

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)O.CN(CCO)CC(CN1C2=CC=CC=C2C3=CC=CC=C31)O

InChI

InChI=1S/C18H22N2O2.C11H14O2/c1-19(10-11-21)12-14(22)13-20-17-8-4-2-6-15(17)16-7-3-5-9-18(16)20;1-11(2,3)9-6-4-8(5-7-9)10(12)13/h2-9,14,21-22H,10-13H2,1H3;4-7H,1-3H3,(H,12,13)