2-[2-[(E)-(carbamothioylhydrazinylidene)methyl]phenoxy]ethanoic acid; neodymium

Systemtic Name: 2-[2-[(E)-(carbamothioylhydrazinylidene)methyl]phenoxy]ethanoic acid; neodymium Openeye Name: 2-[2-[(E)-(carbamothioylhydrazono)methyl]phenoxy]acetic acid; neodymium CAS Name: 2-[2-[(E)-(carbamothioylhydrazinylidene)methyl]phenoxy]acetic acid; neodymium IUPAC Name: 2-[2-[(E)-(carbamothioylhydrazinylidene)methyl]phenoxy]acetic acid; neodymium Traditional Name: neodymium; 2-[2-[(E)-(thiocarbamoylhydrazono)methyl]phenoxy]acetic acid Formula: C30H33N9NdO9S3 MolecularWeight: 904.07292

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C=NNC(=S)N)OCC(=O)O.C1=CC=C(C(=C1)C=NNC(=S)N)OCC(=O)O.C1=CC=C(C(=C1)C=NNC(=S)N)OCC(=O)O.[Nd]

Isomeric SMILES

C1=CC=C(C(=C1)/C=N/NC(=S)N)OCC(=O)O.C1=CC=C(C(=C1)/C=N/NC(=S)N)OCC(=O)O.C1=CC=C(C(=C1)/C=N/NC(=S)N)OCC(=O)O.[Nd]

InChI

InChI=1S/3C10H11N3O3S.Nd/c3*11-10(17)13-12-5-7-3-1-2-4-8(7)16-6-9(14)15;/h3*1-5H,6H2,(H,14,15)(H3,11,13,17);/b3*12-5+;