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

Systemtic Name: N1-[(2S,3R)-3-oxidanyl-1-phenyl-4-(2-propoxyethylamino)butan-2-yl]-N3,N3-dipropyl-benzene-1,3-dicarboxamide Openeye Name: N1-[(1S,2R)-1-benzyl-2-hydroxy-3-(2-propoxyethylamino)propyl]-N3,N3-dipropyl-benzene-1,3-dicarboxamide CAS Name: N1-[(2S,3R)-3-hydroxy-1-phenyl-4-(2-propoxyethylamino)butan-2-yl]-N3,N3-dipropylbenzene-1,3-dicarboxamide IUPAC Name: 1-N-[(2S,3R)-3-hydroxy-1-phenyl-4-(2-propoxyethylamino)butan-2-yl]-3-N,3-N-dipropylbenzene-1,3-dicarboxamide Traditional Name: N-[(1S,2R)-1-benzyl-2-hydroxy-3-(2-propoxyethylamino)propyl]-N',N'-dipropyl-isophthalamide Formula: C29H43N3O4 MolecularWeight: 497.66942

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C29H43N3O4/c1-4-16-32(17-5-2)29(35)25-14-10-13-24(21-25)28(34)31-26(20-23-11-8-7-9-12-23)27(33)22-30-15-19-36-18-6-3/h7-14,21,26-27,30,33H,4-6,15-20,22H2,1-3H3,(H,31,34)/t26-,27+/m0/s1