8-(4-phenylmethoxyphenoxy)octyl (2S)-2-azanyl-3-(1H-indol-3-yl)propanoate

Systemtic Name: 8-(4-phenylmethoxyphenoxy)octyl (2S)-2-azanyl-3-(1H-indol-3-yl)propanoate Openeye Name: 8-(4-benzyloxyphenoxy)octyl (2S)-2-amino-3-(1H-indol-3-yl)propanoate CAS Name: (2S)-2-amino-3-(1H-indol-3-yl)propanoic acid 8-(4-phenylmethoxyphenoxy)octyl ester IUPAC Name: 8-(4-phenylmethoxyphenoxy)octyl (2S)-2-amino-3-(1H-indol-3-yl)propanoate Traditional Name: (2S)-2-amino-3-(1H-indol-3-yl)propionic acid 8-(4-benzoxyphenoxy)octyl ester Formula: C32H38N2O4 MolecularWeight: 514.65512

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=CC=C(C=C2)OCCCCCCCCOC(=O)C(CC3=CNC4=CC=CC=C43)N

Isomeric SMILES

C1=CC=C(C=C1)COC2=CC=C(C=C2)OCCCCCCCCOC(=O)[C@H](CC3=CNC4=CC=CC=C43)N

InChI

InChI=1S/C32H38N2O4/c33-30(22-26-23-34-31-15-9-8-14-29(26)31)32(35)37-21-11-4-2-1-3-10-20-36-27-16-18-28(19-17-27)38-24-25-12-6-5-7-13-25/h5-9,12-19,23,30,34H,1-4,10-11,20-22,24,33H2/t30-/m0/s1