(2S)-2-azanyl-3-(4-hydroxyphenyl)-N-[8-(4-phenylmethoxyphenoxy)octyl]propanamide

Systemtic Name: (2S)-2-azanyl-3-(4-hydroxyphenyl)-N-[8-(4-phenylmethoxyphenoxy)octyl]propanamide Openeye Name: (2S)-2-amino-N-[8-(4-benzyloxyphenoxy)octyl]-3-(4-hydroxyphenyl)propanamide CAS Name: (2S)-2-amino-3-(4-hydroxyphenyl)-N-[8-(4-phenylmethoxyphenoxy)octyl]propanamide IUPAC Name: (2S)-2-amino-3-(4-hydroxyphenyl)-N-[8-(4-phenylmethoxyphenoxy)octyl]propanamide Traditional Name: (2S)-2-amino-N-[8-(4-benzoxyphenoxy)octyl]-3-(4-hydroxyphenyl)propionamide Formula: C30H38N2O4 MolecularWeight: 490.63372

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=CC=C(C=C2)OCCCCCCCCNC(=O)C(CC3=CC=C(C=C3)O)N

Isomeric SMILES

C1=CC=C(C=C1)COC2=CC=C(C=C2)OCCCCCCCCNC(=O)[C@H](CC3=CC=C(C=C3)O)N

InChI

InChI=1S/C30H38N2O4/c31-29(22-24-12-14-26(33)15-13-24)30(34)32-20-8-3-1-2-4-9-21-35-27-16-18-28(19-17-27)36-23-25-10-6-5-7-11-25/h5-7,10-19,29,33H,1-4,8-9,20-23,31H2,(H,32,34)/t29-/m0/s1