ethanedioate; 1-[2-(2-hydroxyethylamino)ethyl]-3-[(4-oxidanylidenecyclohexa-2,5-dien-1-ylidene)methylamino]urea

Systemtic Name: ethanedioate; 1-[2-(2-hydroxyethylamino)ethyl]-3-[(4-oxidanylidenecyclohexa-2,5-dien-1-ylidene)methylamino]urea Openeye Name: 1-[2-(2-hydroxyethylamino)ethyl]-3-[(4-oxocyclohexa-2,5-dien-1-ylidene)methylamino]urea; oxalate CAS Name: 1-[2-(2-hydroxyethylamino)ethyl]-3-[(4-oxo-1-cyclohexa-2,5-dienylidene)methylamino]urea; oxalate IUPAC Name: 1-[2-(2-hydroxyethylamino)ethyl]-3-[(4-oxocyclohexa-2,5-dien-1-ylidene)methylamino]urea; oxalate Traditional Name: 1-[2-(2-hydroxyethylamino)ethyl]-3-[(4-ketocyclohexa-2,5-dien-1-ylidene)methylamino]urea; oxalate Formula: C14H18N4O7-2 MolecularWeight: 354.31532

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=O)C=CC1=CNNC(=O)NCCNCCO.C(=O)(C(=O)[O-])[O-]

Isomeric SMILES

C1=CC(=O)C=CC1=CNNC(=O)NCCNCCO.C(=O)(C(=O)[O-])[O-]

InChI

InChI=1S/C12H18N4O3.C2H2O4/c17-8-7-13-5-6-14-12(19)16-15-9-10-1-3-11(18)4-2-10;3-1(4)2(5)6/h1-4,9,13,15,17H,5-8H2,(H2,14,16,19);(H,3,4)(H,5,6)/p-2