3-(1,3-benzodioxol-5-yl)-6-[[(E)-pyrrol-2-ylidenemethyl]amino]chromen-2-one

Systemtic Name: 3-(1,3-benzodioxol-5-yl)-6-[[(E)-pyrrol-2-ylidenemethyl]amino]chromen-2-one Openeye Name: 3-(1,3-benzodioxol-5-yl)-6-[[(E)-pyrrol-2-ylidenemethyl]amino]chromen-2-one CAS Name: 3-(1,3-benzodioxol-5-yl)-6-[[(E)-2-pyrrolylidenemethyl]amino]-1-benzopyran-2-one IUPAC Name: 3-(1,3-benzodioxol-5-yl)-6-[[(E)-pyrrol-2-ylidenemethyl]amino]chromen-2-one Traditional Name: 3-(1,3-benzodioxol-5-yl)-6-[[(E)-pyrrol-2-ylidenemethyl]amino]coumarin Formula: C21H14N2O4 MolecularWeight: 358.34686

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C3=CC4=C(C=CC(=C4)NC=C5C=CC=N5)OC3=O

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C3=CC4=C(C=CC(=C4)N/C=C/5\C=CC=N5)OC3=O

InChI

InChI=1S/C21H14N2O4/c24-21-17(13-3-5-19-20(10-13)26-12-25-19)9-14-8-15(4-6-18(14)27-21)23-11-16-2-1-7-22-16/h1-11,23H,12H2/b16-11+