3-[(4-hydroxyphenyl)carbonylamino]-4-naphthalen-1-ylcarbonyloxy-azepane-1-carboxylic acid

Systemtic Name: 3-[(4-hydroxyphenyl)carbonylamino]-4-naphthalen-1-ylcarbonyloxy-azepane-1-carboxylic acid Openeye Name: 3-[(4-hydroxybenzoyl)amino]-4-(naphthalene-1-carbonyloxy)azepane-1-carboxylic acid CAS Name: 3-[[(4-hydroxyphenyl)-oxomethyl]amino]-4-[1-naphthalenyl(oxo)methoxy]-1-azepanecarboxylic acid IUPAC Name: 3-[(4-hydroxybenzoyl)amino]-4-(naphthalene-1-carbonyloxy)azepane-1-carboxylic acid Traditional Name: 3-[(4-hydroxybenzoyl)amino]-4-(1-naphthoyloxy)azepane-1-carboxylic acid Formula: C25H24N2O6 MolecularWeight: 448.46786

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C(CN(C1)C(=O)O)NC(=O)C2=CC=C(C=C2)O)OC(=O)C3=CC=CC4=CC=CC=C43

Isomeric SMILES

C1CC(C(CN(C1)C(=O)O)NC(=O)C2=CC=C(C=C2)O)OC(=O)C3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C25H24N2O6/c28-18-12-10-17(11-13-18)23(29)26-21-15-27(25(31)32)14-4-9-22(21)33-24(30)20-8-3-6-16-5-1-2-7-19(16)20/h1-3,5-8,10-13,21-22,28H,4,9,14-15H2,(H,26,29)(H,31,32)