8-azanyl-N-(1-azanyl-1-oxidanylidene-3-phenyl-propan-2-yl)-9-(4-hydroxyphenyl)-3,7-bis(oxidanyl)-2-(phenylmethyl)nonanamide

Systemtic Name: 8-azanyl-N-(1-azanyl-1-oxidanylidene-3-phenyl-propan-2-yl)-9-(4-hydroxyphenyl)-3,7-bis(oxidanyl)-2-(phenylmethyl)nonanamide Openeye Name: 8-amino-N-(2-amino-1-benzyl-2-oxo-ethyl)-2-benzyl-3,7-dihydroxy-9-(4-hydroxyphenyl)nonanamide CAS Name: 8-amino-N-(1-amino-1-oxo-3-phenylpropan-2-yl)-3,7-dihydroxy-9-(4-hydroxyphenyl)-2-(phenylmethyl)nonanamide IUPAC Name: 8-amino-N-(1-amino-1-oxo-3-phenylpropan-2-yl)-2-benzyl-3,7-dihydroxy-9-(4-hydroxyphenyl)nonanamide Traditional Name: 8-amino-N-(2-amino-1-benzyl-2-keto-ethyl)-2-benzyl-3,7-dihydroxy-9-(4-hydroxyphenyl)pelargonamide Formula: C31H39N3O5 MolecularWeight: 533.65846

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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)NC(CC3=CC=CC=C3)C(=O)N

Isomeric SMILES

C1=CC=C(C=C1)CC(C(CCCC(C(CC2=CC=C(C=C2)O)N)O)O)C(=O)NC(CC3=CC=CC=C3)C(=O)N

InChI

InChI=1S/C31H39N3O5/c32-26(19-23-14-16-24(35)17-15-23)29(37)13-7-12-28(36)25(18-21-8-3-1-4-9-21)31(39)34-27(30(33)38)20-22-10-5-2-6-11-22/h1-6,8-11,14-17,25-29,35-37H,7,12-13,18-20,32H2,(H2,33,38)(H,34,39)