2-[[5-(4-azanylbutoxy)-3-oxidanyl-naphthalen-2-yl]carbonylamino]-3-phenyl-propanoic acid

Systemtic Name: 2-[[5-(4-azanylbutoxy)-3-oxidanyl-naphthalen-2-yl]carbonylamino]-3-phenyl-propanoic acid Openeye Name: 2-[[5-(4-aminobutoxy)-3-hydroxy-naphthalene-2-carbonyl]amino]-3-phenyl-propanoic acid CAS Name: 2-[[[5-(4-aminobutoxy)-3-hydroxy-2-naphthalenyl]-oxomethyl]amino]-3-phenylpropanoic acid IUPAC Name: 2-[[5-(4-aminobutoxy)-3-hydroxynaphthalene-2-carbonyl]amino]-3-phenylpropanoic acid Traditional Name: 2-[[5-(4-aminobutoxy)-3-hydroxy-2-naphthoyl]amino]-3-phenyl-propionic acid Formula: C24H26N2O5 MolecularWeight: 422.47364

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C(=O)O)NC(=O)C2=C(C=C3C(=C2)C=CC=C3OCCCCN)O

Isomeric SMILES

C1=CC=C(C=C1)CC(C(=O)O)NC(=O)C2=C(C=C3C(=C2)C=CC=C3OCCCCN)O

InChI

InChI=1S/C24H26N2O5/c25-11-4-5-12-31-22-10-6-9-17-14-19(21(27)15-18(17)22)23(28)26-20(24(29)30)13-16-7-2-1-3-8-16/h1-3,6-10,14-15,20,27H,4-5,11-13,25H2,(H,26,28)(H,29,30)