4-[[4-(aminomethyl)phenyl]carbonylamino]-5-(4-hydroxyphenyl)-3-oxidanylidene-2-piperidin-4-yloxy-pentanoic acid

Systemtic Name: 4-[[4-(aminomethyl)phenyl]carbonylamino]-5-(4-hydroxyphenyl)-3-oxidanylidene-2-piperidin-4-yloxy-pentanoic acid Openeye Name: 4-[[4-(aminomethyl)benzoyl]amino]-5-(4-hydroxyphenyl)-3-oxo-2-(4-piperidyloxy)pentanoic acid CAS Name: 4-[[[4-(aminomethyl)phenyl]-oxomethyl]amino]-5-(4-hydroxyphenyl)-3-oxo-2-(4-piperidinyloxy)pentanoic acid IUPAC Name: 4-[[4-(aminomethyl)benzoyl]amino]-5-(4-hydroxyphenyl)-3-oxo-2-piperidin-4-yloxypentanoic acid Traditional Name: 4-[[4-(aminomethyl)benzoyl]amino]-5-(4-hydroxyphenyl)-3-keto-2-(4-piperidyloxy)valeric acid Formula: C24H29N3O6 MolecularWeight: 455.50356

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCC1OC(C(=O)C(CC2=CC=C(C=C2)O)NC(=O)C3=CC=C(C=C3)CN)C(=O)O

Isomeric SMILES

C1CNCCC1OC(C(=O)C(CC2=CC=C(C=C2)O)NC(=O)C3=CC=C(C=C3)CN)C(=O)O

InChI

InChI=1S/C24H29N3O6/c25-14-16-1-5-17(6-2-16)23(30)27-20(13-15-3-7-18(28)8-4-15)21(29)22(24(31)32)33-19-9-11-26-12-10-19/h1-8,19-20,22,26,28H,9-14,25H2,(H,27,30)(H,31,32)