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

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

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C(C(=O)O)NC(=O)C2=CC3=C(C=C2)C(=CC=C3)OCCCCN)O

Isomeric SMILES

C1=CC=C(C=C1)C(C(C(=O)O)NC(=O)C2=CC3=C(C=C2)C(=CC=C3)OCCCCN)O

InChI

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