N-[2-[[(2R)-2-[3-(hydroxymethyl)-4-oxidanyl-phenyl]-2-oxidanyl-ethyl]amino]propyl]-N-(phenylmethyl)-1H-indole-2-carboxamide

Systemtic Name: N-[2-[[(2R)-2-[3-(hydroxymethyl)-4-oxidanyl-phenyl]-2-oxidanyl-ethyl]amino]propyl]-N-(phenylmethyl)-1H-indole-2-carboxamide Openeye Name: N-benzyl-N-[2-[[(2R)-2-hydroxy-2-[4-hydroxy-3-(hydroxymethyl)phenyl]ethyl]amino]propyl]-1H-indole-2-carboxamide CAS Name: N-[2-[[(2R)-2-hydroxy-2-[4-hydroxy-3-(hydroxymethyl)phenyl]ethyl]amino]propyl]-N-(phenylmethyl)-1H-indole-2-carboxamide IUPAC Name: N-benzyl-N-[2-[[(2R)-2-hydroxy-2-[4-hydroxy-3-(hydroxymethyl)phenyl]ethyl]amino]propyl]-1H-indole-2-carboxamide Traditional Name: N-benzyl-N-[2-[[(2R)-2-hydroxy-2-(4-hydroxy-3-methylol-phenyl)ethyl]amino]propyl]-1H-indole-2-carboxamide Formula: C28H31N3O4 MolecularWeight: 473.56344

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Descriptors Computed from Structure

Canonical SMILES:

CC(CN(CC1=CC=CC=C1)C(=O)C2=CC3=CC=CC=C3N2)NCC(C4=CC(=C(C=C4)O)CO)O

Isomeric SMILES

CC(CN(CC1=CC=CC=C1)C(=O)C2=CC3=CC=CC=C3N2)NC[C@@H](C4=CC(=C(C=C4)O)CO)O

InChI

InChI=1S/C28H31N3O4/c1-19(29-15-27(34)22-11-12-26(33)23(13-22)18-32)16-31(17-20-7-3-2-4-8-20)28(35)25-14-21-9-5-6-10-24(21)30-25/h2-14,19,27,29-30,32-34H,15-18H2,1H3/t19?,27-/m0/s1