3-[[[(E)-1-nitrosopent-1-en-2-yl]amino]-(1,2,3-triazol-1-yl)amino]chromen-2-one

Systemtic Name: 3-[[[(E)-1-nitrosopent-1-en-2-yl]amino]-(1,2,3-triazol-1-yl)amino]chromen-2-one Openeye Name: 3-[[[(1E)-1-(nitrosomethylene)butyl]amino]-(triazol-1-yl)amino]chromen-2-one CAS Name: 3-[[[(E)-1-nitrosopent-1-en-2-yl]amino]-(1-triazolyl)amino]-1-benzopyran-2-one IUPAC Name: 3-[[[(E)-1-nitrosopent-1-en-2-yl]amino]-(triazol-1-yl)amino]chromen-2-one Traditional Name: 3-[[[(E)-2-nitroso-1-propyl-vinyl]amino]-(triazol-1-yl)amino]coumarin Formula: C16H16N6O3 MolecularWeight: 340.33664

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=CN=O)NN(C1=CC2=CC=CC=C2OC1=O)N3C=CN=N3

Isomeric SMILES

CCC/C(=C\N=O)/NN(C1=CC2=CC=CC=C2OC1=O)N3C=CN=N3

InChI

InChI=1S/C16H16N6O3/c1-2-5-13(11-18-24)19-22(21-9-8-17-20-21)14-10-12-6-3-4-7-15(12)25-16(14)23/h3-4,6-11,19H,2,5H2,1H3/b13-11+