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

Systemtic Name: N1-[(2S,3R)-3-oxidanyl-1-phenyl-4-(3-propan-2-yloxypropylamino)butan-2-yl]-N3,N3-dipropyl-benzene-1,3-dicarboxamide Openeye Name: N1-[(1S,2R)-1-benzyl-2-hydroxy-3-(3-isopropoxypropylamino)propyl]-N3,N3-dipropyl-benzene-1,3-dicarboxamide CAS Name: N1-[(2S,3R)-3-hydroxy-1-phenyl-4-(3-propan-2-yloxypropylamino)butan-2-yl]-N3,N3-dipropylbenzene-1,3-dicarboxamide IUPAC Name: 1-N-[(2S,3R)-3-hydroxy-1-phenyl-4-(3-propan-2-yloxypropylamino)butan-2-yl]-3-N,3-N-dipropylbenzene-1,3-dicarboxamide Traditional Name: N-[(1S,2R)-1-benzyl-2-hydroxy-3-(3-isopropoxypropylamino)propyl]-N',N'-dipropyl-isophthalamide Formula: C30H45N3O4 MolecularWeight: 511.696

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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(CNCCCOC(C)C)O

Isomeric SMILES

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

InChI

InChI=1S/C30H45N3O4/c1-5-17-33(18-6-2)30(36)26-15-10-14-25(21-26)29(35)32-27(20-24-12-8-7-9-13-24)28(34)22-31-16-11-19-37-23(3)4/h7-10,12-15,21,23,27-28,31,34H,5-6,11,16-20,22H2,1-4H3,(H,32,35)/t27-,28+/m0/s1