5-(1-butyl-2-oxidanylidene-indol-3-ylidene)-1,3-diazinane-2,4,6-trione

Systemtic Name: 5-(1-butyl-2-oxidanylidene-indol-3-ylidene)-1,3-diazinane-2,4,6-trione Openeye Name: 5-(1-butyl-2-oxo-indolin-3-ylidene)hexahydropyrimidine-2,4,6-trione CAS Name: 5-(1-butyl-2-oxo-3-indolylidene)-1,3-diazinane-2,4,6-trione IUPAC Name: 5-(1-butyl-2-oxoindol-3-ylidene)-1,3-diazinane-2,4,6-trione Traditional Name: 5-(1-butyl-2-keto-indolin-3-ylidene)barbituric acid Formula: C16H15N3O4 MolecularWeight: 313.308

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=CC=CC=C2C(=C3C(=O)NC(=O)NC3=O)C1=O

Isomeric SMILES

CCCCN1C2=CC=CC=C2C(=C3C(=O)NC(=O)NC3=O)C1=O

InChI

InChI=1S/C16H15N3O4/c1-2-3-8-19-10-7-5-4-6-9(10)11(15(19)22)12-13(20)17-16(23)18-14(12)21/h4-7H,2-3,8H2,1H3,(H2,17,18,20,21,23)