N-[(2S,3R)-4-[(3-methoxyphenyl)methylamino]-3-oxidanyl-1-phenyl-butan-2-yl]-3-pyrrolidin-1-ylcarbonyl-benzamide

Systemtic Name: N-[(2S,3R)-4-[(3-methoxyphenyl)methylamino]-3-oxidanyl-1-phenyl-butan-2-yl]-3-pyrrolidin-1-ylcarbonyl-benzamide Openeye Name: N-[(1S,2R)-1-benzyl-2-hydroxy-3-[(3-methoxyphenyl)methylamino]propyl]-3-(pyrrolidine-1-carbonyl)benzamide CAS Name: N-[(2S,3R)-3-hydroxy-4-[(3-methoxyphenyl)methylamino]-1-phenylbutan-2-yl]-3-[oxo(1-pyrrolidinyl)methyl]benzamide IUPAC Name: N-[(2S,3R)-3-hydroxy-4-[(3-methoxyphenyl)methylamino]-1-phenylbutan-2-yl]-3-(pyrrolidine-1-carbonyl)benzamide Traditional Name: N-[(1S,2R)-1-benzyl-2-hydroxy-3-(m-anisylamino)propyl]-3-(pyrrolidine-1-carbonyl)benzamide Formula: C30H35N3O4 MolecularWeight: 501.6166

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)CNCC(C(CC2=CC=CC=C2)NC(=O)C3=CC=CC(=C3)C(=O)N4CCCC4)O

Isomeric SMILES

COC1=CC=CC(=C1)CNC[C@H]([C@H](CC2=CC=CC=C2)NC(=O)C3=CC=CC(=C3)C(=O)N4CCCC4)O

InChI

InChI=1S/C30H35N3O4/c1-37-26-14-7-11-23(17-26)20-31-21-28(34)27(18-22-9-3-2-4-10-22)32-29(35)24-12-8-13-25(19-24)30(36)33-15-5-6-16-33/h2-4,7-14,17,19,27-28,31,34H,5-6,15-16,18,20-21H2,1H3,(H,32,35)/t27-,28+/m0/s1