sodium 5-butyl-5-(2-naphthalen-1-ylethyl)-1,3-diazinane-2,4,6-trione

Systemtic Name: sodium 5-butyl-5-(2-naphthalen-1-ylethyl)-1,3-diazinane-2,4,6-trione Openeye Name: sodium 5-butyl-5-[2-(1-naphthyl)ethyl]hexahydropyrimidine-2,4,6-trione CAS Name: sodium 5-butyl-5-[2-(1-naphthalenyl)ethyl]-1,3-diazinane-2,4,6-trione IUPAC Name: sodium 5-butyl-5-(2-naphthalen-1-ylethyl)-1,3-diazinane-2,4,6-trione Traditional Name: sodium 5-butyl-5-[2-(1-naphthyl)ethyl]barbituric acid Formula: C20H22N2NaO3+ MolecularWeight: 361.39005

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1(C(=O)NC(=O)NC1=O)CCC2=CC=CC3=CC=CC=C32.[Na+]

Isomeric SMILES

CCCCC1(C(=O)NC(=O)NC1=O)CCC2=CC=CC3=CC=CC=C32.[Na+]

InChI

InChI=1S/C20H22N2O3.Na/c1-2-3-12-20(17(23)21-19(25)22-18(20)24)13-11-15-9-6-8-14-7-4-5-10-16(14)15;/h4-10H,2-3,11-13H2,1H3,(H2,21,22,23,24,25);/q;+1