(6-morpholin-4-yl-4,4-diphenyl-hexan-3-yl) 4-azanylbenzoate

Systemtic Name: (6-morpholin-4-yl-4,4-diphenyl-hexan-3-yl) 4-azanylbenzoate Openeye Name: (1-ethyl-4-morpholino-2,2-diphenyl-butyl) 4-aminobenzoate CAS Name: 4-aminobenzoic acid [6-(4-morpholinyl)-4,4-diphenylhexan-3-yl] ester IUPAC Name: (6-morpholin-4-yl-4,4-diphenylhexan-3-yl) 4-aminobenzoate Traditional Name: 4-aminobenzoic acid (1-ethyl-4-morpholino-2,2-diphenyl-butyl) ester Formula: C29H34N2O3 MolecularWeight: 458.59186

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C(CCN1CCOCC1)(C2=CC=CC=C2)C3=CC=CC=C3)OC(=O)C4=CC=C(C=C4)N

Isomeric SMILES

CCC(C(CCN1CCOCC1)(C2=CC=CC=C2)C3=CC=CC=C3)OC(=O)C4=CC=C(C=C4)N

InChI

InChI=1S/C29H34N2O3/c1-2-27(34-28(32)23-13-15-26(30)16-14-23)29(24-9-5-3-6-10-24,25-11-7-4-8-12-25)17-18-31-19-21-33-22-20-31/h3-16,27H,2,17-22,30H2,1H3