4-butyl-6-chloranyl-7-(1,2,3-triaza-4-azanidacyclopenta-2,5-dien-5-ylmethoxy)chromen-2-one

Systemtic Name: 4-butyl-6-chloranyl-7-(1,2,3-triaza-4-azanidacyclopenta-2,5-dien-5-ylmethoxy)chromen-2-one Openeye Name: 4-butyl-6-chloro-7-(1,2,3-triaza-4-azanidacyclopenta-2,5-dien-5-ylmethoxy)chromen-2-one CAS Name: 4-butyl-6-chloro-7-(1,2,3-triaza-4-azanidacyclopenta-2,5-dien-5-ylmethoxy)-1-benzopyran-2-one IUPAC Name: 4-butyl-6-chloro-7-(1,2,3-triaza-4-azanidacyclopenta-2,5-dien-5-ylmethoxy)chromen-2-one Traditional Name: 4-butyl-6-chloro-7-(1,2,3-triaza-4-azanidacyclopenta-2,5-dien-5-ylmethoxy)coumarin Formula: C15H14ClN4O3- MolecularWeight: 333.74966

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC(=O)OC2=CC(=C(C=C12)Cl)OCC3=NN=N[N-]3

Isomeric SMILES

CCCCC1=CC(=O)OC2=CC(=C(C=C12)Cl)OCC3=NN=N[N-]3

InChI

InChI=1S/C15H14ClN4O3/c1-2-3-4-9-5-15(21)23-12-7-13(11(16)6-10(9)12)22-8-14-17-19-20-18-14/h5-7H,2-4,8H2,1H3/q-1