6-(3-azanylpyrrolidin-1-yl)-2-oxidanyl-1,3-bis(oxidanylidene)benzo[de]isoquinoline-5-carbonitrile

Systemtic Name: 6-(3-azanylpyrrolidin-1-yl)-2-oxidanyl-1,3-bis(oxidanylidene)benzo[de]isoquinoline-5-carbonitrile Openeye Name: 6-(3-aminopyrrolidin-1-yl)-2-hydroxy-1,3-dioxo-benzo[de]isoquinoline-5-carbonitrile CAS Name: 6-(3-amino-1-pyrrolidinyl)-2-hydroxy-1,3-dioxo-5-benzo[de]isoquinolinecarbonitrile IUPAC Name: 6-(3-aminopyrrolidin-1-yl)-2-hydroxy-1,3-dioxobenzo[de]isoquinoline-5-carbonitrile Traditional Name: 6-(3-aminopyrrolidino)-2-hydroxy-1,3-diketo-benzo[de]isoquinoline-5-carbonitrile Formula: C17H14N4O3 MolecularWeight: 322.31806

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC1N)C2=C3C=CC=C4C3=C(C=C2C#N)C(=O)N(C4=O)O

Isomeric SMILES

C1CN(CC1N)C2=C3C=CC=C4C3=C(C=C2C#N)C(=O)N(C4=O)O

InChI

InChI=1S/C17H14N4O3/c18-7-9-6-13-14-11(15(9)20-5-4-10(19)8-20)2-1-3-12(14)16(22)21(24)17(13)23/h1-3,6,10,24H,4-5,8,19H2