4-(1,3-benzodioxol-4-ylamino)-6-methoxy-7-oxidanylidene-1H-quinoline-3-carbonitrile

Systemtic Name: 4-(1,3-benzodioxol-4-ylamino)-6-methoxy-7-oxidanylidene-1H-quinoline-3-carbonitrile Openeye Name: 4-(1,3-benzodioxol-4-ylamino)-6-methoxy-7-oxo-1H-quinoline-3-carbonitrile CAS Name: 4-(1,3-benzodioxol-4-ylamino)-6-methoxy-7-oxo-1H-quinoline-3-carbonitrile IUPAC Name: 4-(1,3-benzodioxol-4-ylamino)-6-methoxy-7-oxo-1H-quinoline-3-carbonitrile Traditional Name: 4-(1,3-benzodioxol-4-ylamino)-7-keto-6-methoxy-1H-quinoline-3-carbonitrile Formula: C18H13N3O4 MolecularWeight: 335.31352

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C(=CNC2=CC1=O)C#N)NC3=C4C(=CC=C3)OCO4

Isomeric SMILES

COC1=CC2=C(C(=CNC2=CC1=O)C#N)NC3=C4C(=CC=C3)OCO4

InChI

InChI=1S/C18H13N3O4/c1-23-16-5-11-13(6-14(16)22)20-8-10(7-19)17(11)21-12-3-2-4-15-18(12)25-9-24-15/h2-6,8,20-21H,9H2,1H3