8-azanyl-9-(4-hydroxyphenyl)-3,7-bis(oxidanyl)-2-(phenylmethyl)nonanoic acid

Systemtic Name: 8-azanyl-9-(4-hydroxyphenyl)-3,7-bis(oxidanyl)-2-(phenylmethyl)nonanoic acid Openeye Name: 8-amino-2-benzyl-3,7-dihydroxy-9-(4-hydroxyphenyl)nonanoic acid CAS Name: 8-amino-3,7-dihydroxy-9-(4-hydroxyphenyl)-2-(phenylmethyl)nonanoic acid IUPAC Name: 8-amino-2-benzyl-3,7-dihydroxy-9-(4-hydroxyphenyl)nonanoic acid Traditional Name: 8-amino-2-benzyl-3,7-dihydroxy-9-(4-hydroxyphenyl)pelargonic acid Formula: C22H29NO5 MolecularWeight: 387.46936

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C(CCCC(C(CC2=CC=C(C=C2)O)N)O)O)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)CC(C(CCCC(C(CC2=CC=C(C=C2)O)N)O)O)C(=O)O

InChI

InChI=1S/C22H29NO5/c23-19(14-16-9-11-17(24)12-10-16)21(26)8-4-7-20(25)18(22(27)28)13-15-5-2-1-3-6-15/h1-3,5-6,9-12,18-21,24-26H,4,7-8,13-14,23H2,(H,27,28)