4-azanyl-1-heptyl-2-oxidanylidene-N-[(E)-pyridin-4-ylmethylideneamino]quinoline-3-carboxamide

Systemtic Name: 4-azanyl-1-heptyl-2-oxidanylidene-N-[(E)-pyridin-4-ylmethylideneamino]quinoline-3-carboxamide Openeye Name: 4-amino-1-heptyl-2-oxo-N-[(E)-4-pyridylmethyleneamino]quinoline-3-carboxamide CAS Name: 4-amino-1-heptyl-2-oxo-N-[(E)-pyridin-4-ylmethylideneamino]-3-quinolinecarboxamide IUPAC Name: 4-amino-1-heptyl-2-oxo-N-[(E)-pyridin-4-ylmethylideneamino]quinoline-3-carboxamide Traditional Name: 4-amino-1-heptyl-2-keto-N-[(E)-4-pyridylmethyleneamino]quinoline-3-carboxamide Formula: C23H27N5O2 MolecularWeight: 405.49278

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCN1C2=CC=CC=C2C(=C(C1=O)C(=O)NN=CC3=CC=NC=C3)N

Isomeric SMILES

CCCCCCCN1C2=CC=CC=C2C(=C(C1=O)C(=O)N/N=C/C3=CC=NC=C3)N

InChI

InChI=1S/C23H27N5O2/c1-2-3-4-5-8-15-28-19-10-7-6-9-18(19)21(24)20(23(28)30)22(29)27-26-16-17-11-13-25-14-12-17/h6-7,9-14,16H,2-5,8,15,24H2,1H3,(H,27,29)/b26-16+