7-azanyl-4-chloranyl-3-propoxy-isochromen-1-one

Systemtic Name: 7-azanyl-4-chloranyl-3-propoxy-isochromen-1-one Openeye Name: 7-amino-4-chloro-3-propoxy-isochromen-1-one CAS Name: 7-amino-4-chloro-3-propoxy-2-benzopyran-1-one IUPAC Name: 7-amino-4-chloro-3-propoxyisochromen-1-one Traditional Name: 7-amino-4-chloro-3-propoxy-isocoumarin Formula: C12H12ClNO3 MolecularWeight: 253.68158

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C2=C(C=C(C=C2)N)C(=O)O1)Cl

Isomeric SMILES

CCCOC1=C(C2=C(C=C(C=C2)N)C(=O)O1)Cl

InChI

InChI=1S/C12H12ClNO3/c1-2-5-16-12-10(13)8-4-3-7(14)6-9(8)11(15)17-12/h3-4,6H,2,5,14H2,1H3