N1-[(2S,3R)-3-oxidanyl-4-(2-phenoxyethylamino)-1-phenyl-butan-2-yl]-N3,N3-dipropyl-benzene-1,3-dicarboxamide

Systemtic Name: N1-[(2S,3R)-3-oxidanyl-4-(2-phenoxyethylamino)-1-phenyl-butan-2-yl]-N3,N3-dipropyl-benzene-1,3-dicarboxamide Openeye Name: N1-[(1S,2R)-1-benzyl-2-hydroxy-3-(2-phenoxyethylamino)propyl]-N3,N3-dipropyl-benzene-1,3-dicarboxamide CAS Name: N1-[(2S,3R)-3-hydroxy-4-(2-phenoxyethylamino)-1-phenylbutan-2-yl]-N3,N3-dipropylbenzene-1,3-dicarboxamide IUPAC Name: 1-N-[(2S,3R)-3-hydroxy-4-(2-phenoxyethylamino)-1-phenylbutan-2-yl]-3-N,3-N-dipropylbenzene-1,3-dicarboxamide Traditional Name: N-[(1S,2R)-1-benzyl-2-hydroxy-3-(2-phenoxyethylamino)propyl]-N',N'-dipropyl-isophthalamide Formula: C32H41N3O4 MolecularWeight: 531.68564

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCN(CCC)C(=O)C1=CC=CC(=C1)C(=O)NC(CC2=CC=CC=C2)C(CNCCOC3=CC=CC=C3)O

Isomeric SMILES

CCCN(CCC)C(=O)C1=CC=CC(=C1)C(=O)N[C@@H](CC2=CC=CC=C2)[C@@H](CNCCOC3=CC=CC=C3)O

InChI

InChI=1S/C32H41N3O4/c1-3-19-35(20-4-2)32(38)27-15-11-14-26(23-27)31(37)34-29(22-25-12-7-5-8-13-25)30(36)24-33-18-21-39-28-16-9-6-10-17-28/h5-17,23,29-30,33,36H,3-4,18-22,24H2,1-2H3,(H,34,37)/t29-,30+/m0/s1