2-[[4-[2-(3-chloranyl-4-oxidanyl-phenyl)-2-oxidanylidene-ethanehydrazonoyl]naphthalen-1-yl]methoxycarbonylamino]-4-methyl-pentanoic acid

Systemtic Name: 2-[[4-[2-(3-chloranyl-4-oxidanyl-phenyl)-2-oxidanylidene-ethanehydrazonoyl]naphthalen-1-yl]methoxycarbonylamino]-4-methyl-pentanoic acid Openeye Name: 2-[[4-[2-(3-chloro-4-hydroxy-phenyl)-2-oxo-ethanehydrazonoyl]-1-naphthyl]methoxycarbonylamino]-4-methyl-pentanoic acid CAS Name: 2-[[[4-[(1Z)-2-(3-chloro-4-hydroxyphenyl)-1-hydrazinylidene-2-oxoethyl]-1-naphthalenyl]methoxy-oxomethyl]amino]-4-methylpentanoic acid IUPAC Name: 2-[[4-[2-(3-chloro-4-hydroxyphenyl)-2-oxoethanehydrazonoyl]naphthalen-1-yl]methoxycarbonylamino]-4-methylpentanoic acid Traditional Name: 2-[[4-[2-(3-chloro-4-hydroxy-phenyl)-2-keto-acetohydrazonoyl]-1-naphthyl]methoxycarbonylamino]-4-methyl-valeric acid Formula: C26H26ClN3O6 MolecularWeight: 511.95414

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)O)NC(=O)OCC1=CC=C(C2=CC=CC=C12)C(=NN)C(=O)C3=CC(=C(C=C3)O)Cl

Isomeric SMILES

CC(C)CC(C(=O)O)NC(=O)OCC1=CC=C(C2=CC=CC=C12)/C(=N/N)/C(=O)C3=CC(=C(C=C3)O)Cl

InChI

InChI=1S/C26H26ClN3O6/c1-14(2)11-21(25(33)34)29-26(35)36-13-16-7-9-19(18-6-4-3-5-17(16)18)23(30-28)24(32)15-8-10-22(31)20(27)12-15/h3-10,12,14,21,31H,11,13,28H2,1-2H3,(H,29,35)(H,33,34)/b30-23-