3-azanylpropyl 4-oxidanyl-2-phenoxy-4-(4-phenylmethoxyphenyl)butanoate

Systemtic Name: 3-azanylpropyl 4-oxidanyl-2-phenoxy-4-(4-phenylmethoxyphenyl)butanoate Openeye Name: 3-aminopropyl 4-(4-benzyloxyphenyl)-4-hydroxy-2-phenoxy-butanoate CAS Name: 4-hydroxy-2-phenoxy-4-(4-phenylmethoxyphenyl)butanoic acid 3-aminopropyl ester IUPAC Name: 3-aminopropyl 4-hydroxy-2-phenoxy-4-(4-phenylmethoxyphenyl)butanoate Traditional Name: 4-(4-benzoxyphenyl)-4-hydroxy-2-phenoxy-butyric acid 3-aminopropyl ester Formula: C26H29NO5 MolecularWeight: 435.51216

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=CC=C(C=C2)C(CC(C(=O)OCCCN)OC3=CC=CC=C3)O

Isomeric SMILES

C1=CC=C(C=C1)COC2=CC=C(C=C2)C(CC(C(=O)OCCCN)OC3=CC=CC=C3)O

InChI

InChI=1S/C26H29NO5/c27-16-7-17-30-26(29)25(32-23-10-5-2-6-11-23)18-24(28)21-12-14-22(15-13-21)31-19-20-8-3-1-4-9-20/h1-6,8-15,24-25,28H,7,16-19,27H2