2-hydroxyethyl-[(2S)-3-indol-1-yl-2-oxidanyl-propyl]-[(2S)-2-oxidanyl-3-phenylmethoxy-propyl]azanium

Systemtic Name: 2-hydroxyethyl-[(2S)-3-indol-1-yl-2-oxidanyl-propyl]-[(2S)-2-oxidanyl-3-phenylmethoxy-propyl]azanium Openeye Name: [(2S)-3-benzyloxy-2-hydroxy-propyl]-(2-hydroxyethyl)-[(2S)-2-hydroxy-3-indol-1-yl-propyl]ammonium CAS Name: 2-hydroxyethyl-[(2S)-2-hydroxy-3-(1-indolyl)propyl]-[(2S)-2-hydroxy-3-phenylmethoxypropyl]ammonium IUPAC Name: 2-hydroxyethyl-[(2S)-2-hydroxy-3-indol-1-ylpropyl]-[(2S)-2-hydroxy-3-phenylmethoxypropyl]azanium Traditional Name: [(2S)-3-benzoxy-2-hydroxy-propyl]-(2-hydroxyethyl)-[(2S)-2-hydroxy-3-indol-1-yl-propyl]ammonium Formula: C23H31N2O4+ MolecularWeight: 399.50324

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COCC(C[NH+](CCO)CC(CN2C=CC3=CC=CC=C32)O)O

Isomeric SMILES

C1=CC=C(C=C1)COC[C@H](C[NH+](CCO)C[C@H](CN2C=CC3=CC=CC=C32)O)O

InChI

InChI=1S/C23H30N2O4/c26-13-12-24(15-22(28)18-29-17-19-6-2-1-3-7-19)14-21(27)16-25-11-10-20-8-4-5-9-23(20)25/h1-11,21-22,26-28H,12-18H2/p+1/t21-,22+/m1/s1